Elobixibat Impurity 2 CAS#: 1907648-75-2

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Elobixibat Impurity 2
分子结构
CAS编号 1907648-75-2
EINECS Number
MDL Number
Beilstein Registry Number
别名 7-Bromo-3,3-dibutyl-8-methoxy-5-phenyl-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepine
分子式 C24H32BrNOS
分子量 462.5
InChI
InChI Key
Canonical SMILES CCCCC1(CN(C2=CC=CC=C2)C(C(SC1)=C3)=CC(Br)=C3OC)CCCC

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Elobixibat Impurity 2 is chemically 7-Bromo-3,3-dibutyl-8-methoxy-5-phenyl-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepine. Elobixibat Impurity 2 is supplied with detailed characterization data compliant with regulatory guideline. Elobixibat Impurity 2 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Elobixibat. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Elobixibat Impurity 4 CAS#: 439089-12-0

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Elobixibat Impurity 4
分子结构
CAS编号 439089-12-0
EINECS Number
MDL Number
Beilstein Registry Number
别名 Ethyl 2-((3,3-dibutyl-7-(methylthio)-1,1-dioxido-5-phenyl-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-8-yl)oxy)acetate
分子式 C28H39NO5S2
分子量 533.7
InChI
InChI Key
Canonical SMILES CCCCC(CN(C1=CC=CC=C1)C2=CC(SC)=C3OCC(OCC)=O)(C[S](=O)(C2=C3)=O)CCCC

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Elobixibat Impurity 4 is chemically Ethyl 2-((3,3-dibutyl-7-(methylthio)-1,1-dioxido-5-phenyl-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-8-yl)oxy)acetate. Elobixibat Impurity 4 is supplied with detailed characterization data compliant with regulatory guideline. Elobixibat Impurity 4 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Elobixibat. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

N-Nitroso Elobixibat Impurity 1 CAS#: N/A

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 N-Nitroso Elobixibat Impurity 1
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 (S)-2-((R)-2-(2-(5-(N-(5-Formylnonan-5-yl)sulfamoyl)-2-(methylthio)-4-(nitroso(phenyl)amino)phenoxy)acetamido)-2-(4-hydroxyphenyl)acetamido)butanoic acid
分子式 C37H47N5O10S2
分子量 785.9
InChI
InChI Key
Canonical SMILES CC[C@H](NC([C@H](NC(COC1=CC(S(=O)(NC(CCCC)(C=O)CCCC)=O)=C(N(N=O)C2=CC=CC=C2)C=C1SC)=O)C3=CC=C(O)C=C3)=O)C(O)=O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
N-Nitroso Elobixibat Impurity 1 is chemically (S)-2-((R)-2-(2-(5-(N-(5-Formylnonan-5-yl)sulfamoyl)-2-(methylthio)-4-(nitroso(phenyl)amino)phenoxy)acetamido)-2-(4-hydroxyphenyl)acetamido)butanoic acid. N-Nitroso Elobixibat Impurity 1 is supplied with detailed characterization data compliant with regulatory guideline. N-Nitroso Elobixibat Impurity 1 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Elobixibat. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Elobixibat D5 CAS#: N/A

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Elobixibat D5
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 (S)-(2-(2-((3,3-dibutyl-7-(methylthio)-1,1-dioxido-5-(phenyl-d5)-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-8-yl)oxy)acetamido)-2-phenylacetyl)glycine
分子式 C36H40D5N3O7S2
分子量 700.9
InChI
InChI Key
Canonical SMILES O=[S]1(C2=CC(OCC(N[C@@H](C3=CC=CC=C3)C(NCC(O)=O)=O)=O)=C(SC)C=C2N(C4=C([2H])C([2H])=C([2H])C([2H])=C4[2H])CC(CCCC)(CCCC)C1)=O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Elobixibat D5 is chemically (S)-(2-(2-((3,3-dibutyl-7-(methylthio)-1,1-dioxido-5-(phenyl-d5)-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-8-yl)oxy)acetamido)-2-phenylacetyl)glycine. Elobixibat D5 is supplied with detailed characterization data compliant with regulatory guideline. Elobixibat D5 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Elobixibat. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Elobixibat Ethyl Ester Impurity CAS#: N/A

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Elobixibat Ethyl Ester Impurity
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 Ethyl (R)-(2-(2-((3,3-dibutyl-7-(methylthio)-1,1-dioxido-5-phenyl-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-8-yl)oxy)acetamido)-2-phenylacetyl)glycinate
分子式 C38H49N3O7S2
分子量 723.9
InChI
InChI Key
Canonical SMILES CCCCC(C1)(CCCC)CN(C2=CC=CC=C2)C3=CC(SC)=C(OCC(N[C@@H](C(NCC(OCC)=O)=O)C4=CC=CC=C4)=O)C=C3S1(=O)=O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Elobixibat Ethyl Ester Impurity is chemically Ethyl (R)-(2-(2-((3,3-dibutyl-7-(methylthio)-1,1-dioxido-5-phenyl-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-8-yl)oxy)acetamido)-2-phenylacetyl)glycinate. Elobixibat Ethyl Ester Impurity is supplied with detailed characterization data compliant with regulatory guideline. Elobixibat Ethyl Ester Impurity can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Elobixibat. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Elobixibat N Tertiary-butyl Impurity CAS#: N/A

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Elobixibat N Tertiary-butyl Impurity
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 (R)-(2-(N-(tert-butyl)-2-((3,3-dibutyl-7-(methylthio)-1,1-dioxido-5-phenyl-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-8-yl)oxy)acetamido)-2-phenylacetyl)glycine
分子式 C40H53N3O7S2
分子量 752.0
InChI
InChI Key
Canonical SMILES O=C(O)CNC([C@H](N(C(COC1=C(SC)C=C(C2=C1)N(C3=CC=CC=C3)CC(CCCC)(CCCC)CS2(=O)=O)=O)C(C)(C)C)C4=CC=CC=C4)=O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Elobixibat N Tertiary-butyl Impurity is chemically (R)-(2-(N-(tert-butyl)-2-((3,3-dibutyl-7-(methylthio)-1,1-dioxido-5-phenyl-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-8-yl)oxy)acetamido)-2-phenylacetyl)glycine. Elobixibat N Tertiary-butyl Impurity is supplied with detailed characterization data compliant with regulatory guideline. Elobixibat N Tertiary-butyl Impurity can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Elobixibat. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Elobixibat S-Isomer CAS#: 439087-68-0

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Elobixibat S-Isomer
分子结构
CAS编号 439087-68-0
EINECS Number
MDL Number
Beilstein Registry Number
别名 (S)-(2-(2-((3,3-Dibutyl-7-(methylthio)-1,1-dioxido-5-phenyl-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-8-yl)oxy)acetamido)-2-phenylacetyl)glycine
分子式 C36H45N3O7S2
分子量 695.9
InChI
InChI Key
Canonical SMILES CCCCC(C1)(CCCC)CN(C2=CC=CC=C2)C3=CC(SC)=C(OCC(N[C@H](C(NCC(O)=O)=O)C4=CC=CC=C4)=O)C=C3S1(=O)=O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Elobixibat S-Isomer is chemically (S)-(2-(2-((3,3-Dibutyl-7-(methylthio)-1,1-dioxido-5-phenyl-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-8-yl)oxy)acetamido)-2-phenylacetyl)glycine. Elobixibat S-Isomer is supplied with detailed characterization data compliant with regulatory guideline. Elobixibat S-Isomer can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Elobixibat. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Elobixibat Impurity 5 CAS#: 358375-95-8

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Elobixibat Impurity 5
分子结构
CAS编号 358375-95-8
EINECS Number
MDL Number
Beilstein Registry Number
别名 2-((7-Bromo-3,3-dibutyl-1,1-dioxido-5-phenyl-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-8-yl)oxy)acetic acid
分子式 C25H32BrNO5S
分子量 538.5
InChI
InChI Key
Canonical SMILES CCCCC(CN(C1=CC=CC=C1)C2=CC(Br)=C3OCC(O)=O)(C[S](=O)(C2=C3)=O)CCCC

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Elobixibat Impurity 5 is chemically 2-((7-Bromo-3,3-dibutyl-1,1-dioxido-5-phenyl-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-8-yl)oxy)acetic acid. Elobixibat Impurity 5 is supplied with detailed characterization data compliant with regulatory guideline. Elobixibat Impurity 5 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Elobixibat. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Elobixibat Impurity 3 CAS#: 439089-25-5

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Elobixibat Impurity 3
分子结构
CAS编号 439089-25-5
EINECS Number
MDL Number
Beilstein Registry Number
别名 7-Bromo-3,3-dibutyl-8-methoxy-5-phenyl-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepine 1,1-dioxide
分子式 C24H32BrNO3S
分子量 494.5
InChI
InChI Key
Canonical SMILES CCCCC(CN(C1=CC=CC=C1)C2=CC(Br)=C3OC)(C[S](=O)(C2=C3)=O)CCCC

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Elobixibat Impurity 3 is chemically 7-Bromo-3,3-dibutyl-8-methoxy-5-phenyl-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepine 1,1-dioxide. Elobixibat Impurity 3 is supplied with detailed characterization data compliant with regulatory guideline. Elobixibat Impurity 3 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Elobixibat. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.

Elobixibat Impurity 6 CAS#: N/A

By great_watson-int,
Identification Physical Data Spectra
Route of Synthesis (ROS) Safety and Hazards Other Data

Identification

英文名 Elobixibat Impurity 6
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 Tert-butyl (S)-(2-amino-2-phenylacetyl)glycinate
分子式 C14H20N2O3
分子量 264.3
InChI
InChI Key
Canonical SMILES O=C(OC(C)(C)C)CNC([C@@H](N)C1=CC=CC=C1)=O

Physical Data

Appearance No data available
Solubility No data available
Flash Point No data available
Refractive index No data available
Sensitivity No data available
Melting Point No data available

Spectra

No data available

Route of Synthesis (ROS)

No data available

Safety and Hazards

No data available

Other Data

HS Code 382290
Storage At room temperature and away from light
Related Chemicals
Use Pattern
Elobixibat Impurity 6 is chemically Tert-butyl (S)-(2-amino-2-phenylacetyl)glycinate. Elobixibat Impurity 6 is supplied with detailed characterization data compliant with regulatory guideline. Elobixibat Impurity 6 can be used for the analytical method development, method validation (AMV), Quality Controlled (QC) application for Abbreviated New Drug Application (ANDA) or during commercial production of Elobixibat. The product can be used as reference standards and further traceability against pharmacopeial standards (USP or EP) can be provided based on feasibility. ChemWhat products are for analytical purpose only and not for human use.