Bedaquiline Nitroso 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 Bedaquiline Nitroso Impurity 1
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 N-((3S,4R)-3-hydroxy-4-(2-methoxyquinolin-3-yl)-3-(naphthalen-1-yl)-4-phenylbutyl)-N-methylnitrous amide
分子式 C31H29N3O3
分子量 491.6
InChI
InChI Key
Canonical SMILES O=NN(CC[C@](C1=C2C=CC=CC2=CC=C1)(O)[C@@H](C3=CC4=CC=CC=C4N=C3OC)C5=CC=CC=C5)C

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
Bedaquiline Nitroso Impurity 1 is chemically N-((3S,4R)-3-hydroxy-4-(2-methoxyquinolin-3-yl)-3-(naphthalen-1-yl)-4-phenylbutyl)-N-methylnitrous amide. Bedaquiline Nitroso Impurity 1 is supplied with detailed characterization data compliant with regulatory guideline. Bedaquiline Nitroso 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 Bedaquiline. 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.

Rac-Bedaquiline CAS#: 654655-80-8

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

Identification

英文名 Rac-Bedaquiline
分子结构
CAS编号 654655-80-8
EINECS Number
MDL Number
Beilstein Registry Number
别名 1-(6-Bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-(naphthalen-1-yl)-1-phenylbutan-2-ol
分子式 C32H31BrN2O2
分子量 555.5
InChI
InChI Key
Canonical SMILES OC(CCN(C)C)(C1=C2C=CC=CC2=CC=C1)C(C3=CC4=CC(Br)=CC=C4N=C3OC)C5=CC=CC=C5

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
Rac-Bedaquiline is chemically 1-(6-Bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-(naphthalen-1-yl)-1-phenylbutan-2-ol. Rac-Bedaquiline is supplied with detailed characterization data compliant with regulatory guideline. Rac-Bedaquiline 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 Bedaquiline. 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.

Bedaquiline Impurity 5 CAS#: 654655-69-3

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

Identification

英文名 Bedaquiline Impurity 5
分子结构
CAS编号 654655-69-3
EINECS Number
MDL Number
Beilstein Registry Number
别名 3-Benzyl-6-bromo-2-methoxyquinoline
分子式 C17H14BrNO
分子量 328.2
InChI
InChI Key
Canonical SMILES COC1=NC2=CC=C(Br)C=C2C=C1CC3=CC=CC=C3

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
Bedaquiline Impurity 5 is chemically 3-Benzyl-6-bromo-2-methoxyquinoline. Bedaquiline Impurity 5 is supplied with detailed characterization data compliant with regulatory guideline. Bedaquiline 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 Bedaquiline. 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.

Bedaquiline Impurity 4 CAS#: N/A

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

Identification

英文名 Bedaquiline Impurity 4
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 2-(3-((1R,2S)-4-(dimethylamino)-2-hydroxy-2-(naphthalen-1-yl)-1-phenylbutyl)-2-methoxyquinolin-6-yl)fumaric acid
分子式 C36H34N2O6
分子量 590.7
InChI
InChI Key
Canonical SMILES O[C@@](CCN(C)C)([C@H](C1=CC=CC=C1)C2=CC3=CC(/C(C(O)=O)=CC(O)=O)=CC=C3N=C2OC)C4=C(C=CC=C5)C5=CC=C4

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
Bedaquiline Impurity 4 is chemically 2-(3-((1R,2S)-4-(dimethylamino)-2-hydroxy-2-(naphthalen-1-yl)-1-phenylbutyl)-2-methoxyquinolin-6-yl)fumaric acid. Bedaquiline Impurity 4 is supplied with detailed characterization data compliant with regulatory guideline. Bedaquiline 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 Bedaquiline. 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.

Bedaquiline Impurity 8 CAS#: 1381767-10-7

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

Identification

英文名 Bedaquiline Impurity 8
分子结构
CAS编号 1381767-10-7
EINECS Number
MDL Number
Beilstein Registry Number
别名 3-Benzyl-2-methoxyquinoline
分子式 C17H15NO
分子量 249.3
InChI
InChI Key
Canonical SMILES COC1=NC2=CC=CC=C2C=C1CC3=CC=CC=C3

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
Bedaquiline Impurity 8 is chemically 3-Benzyl-2-methoxyquinoline. Bedaquiline Impurity 8 is supplied with detailed characterization data compliant with regulatory guideline. Bedaquiline Impurity 8 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 Bedaquiline. 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.

Bedaquiline CAS#: 843663-66-1

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

Identification

英文名 Bedaquiline
分子结构
CAS编号 843663-66-1
EINECS Number
MDL Number
Beilstein Registry Number
别名 (1R,2S)-1-(6-Bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-(naphthalen-1-yl)-1-phenylbutan-2-ol
分子式 C32H31BrN2O2
分子量 555.5
InChI
InChI Key
Canonical SMILES O[C@](CCN(C)C)(C1=CC=CC2=C1C=CC=C2)[C@H](C3=CC=CC=C3)C4=CC(C=C(Br)C=C5)=C5N=C4OC

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 845533-86-0 (fumarate salt)
Use Pattern
Bedaquiline is chemically (1R,2S)-1-(6-Bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-(naphthalen-1-yl)-1-phenylbutan-2-ol. Bedaquiline is supplied with detailed characterization data compliant with regulatory guideline. Bedaquiline 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 Bedaquiline. 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 Bedaquiline Impurity 2 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 Bedaquiline Impurity 2
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 N-methyl-N-(3-(naphthalen-1-yl)-3-oxopropyl)nitrous amide
分子式 C14H14N2O2
分子量 242.3
InChI
InChI Key
Canonical SMILES O=NN(C)CCC(C1=C2C=CC=CC2=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
N-Nitroso Bedaquiline Impurity 2 is chemically N-methyl-N-(3-(naphthalen-1-yl)-3-oxopropyl)nitrous amide. N-Nitroso Bedaquiline Impurity 2 is supplied with detailed characterization data compliant with regulatory guideline. N-Nitroso Bedaquiline 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 Bedaquiline. 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.

Bedaquiline Impurity 7 CAS#: 39648-67-4

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

Identification

英文名 Bedaquiline Impurity 7
分子结构
CAS编号 39648-67-4
EINECS Number
MDL Number
Beilstein Registry Number
别名 4-Hydroxydinaphtho[2,1-d:1′,2′-f][1,3,2]dioxaphosphepine 4-oxide
分子式 C20H13O4P
分子量 348.3
InChI
InChI Key
Canonical SMILES O=[P]1(OC2=C(C3=CC=CC=C3C=C2)C(C4=CC=CC=C4C=C5)=C5O1)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
Bedaquiline Impurity 7 is chemically 4-Hydroxydinaphtho[2,1-d:1′,2′-f][1,3,2]dioxaphosphepine 4-oxide. Bedaquiline Impurity 7 is supplied with detailed characterization data compliant with regulatory guideline. Bedaquiline Impurity 7 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 Bedaquiline. 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.

Bedaquiline Enantiomer Impurity Fumarate Salt CAS#: N/A

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

Identification

英文名 Bedaquiline Enantiomer Impurity Fumarate Salt
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 (1S,2R)-1-(6-Bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-(naphthalen-1-yl)-1-phenylbutan-2-ol fumarate
分子式 C32H31BrN2O2 : C4H4O4
分子量 555.5 : 116.1
InChI
InChI Key
Canonical SMILES OC(/C=C/C(O)=O)=O.O[C@@](CCN(C)C)(C1=C2C=CC=CC2=CC=C1)[C@H](C3=CC4=CC(Br)=CC=C4N=C3OC)C5=CC=CC=C5

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 857086-93-2 (free base)
Use Pattern
Bedaquiline Enantiomer Impurity Fumarate Salt is chemically (1S,2R)-1-(6-Bromo-2-methoxyquinolin-3-yl)-4-(dimethylamino)-2-(naphthalen-1-yl)-1-phenylbutan-2-ol fumarate. Bedaquiline Enantiomer Impurity Fumarate Salt is supplied with detailed characterization data compliant with regulatory guideline. Bedaquiline Enantiomer Impurity Fumarate Salt 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 Bedaquiline. 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.

Bedaquiline Des-Bromo 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 Bedaquiline Des-Bromo Impurity
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 (1R,2S)-4-(Dimethylamino)-1-(2-methoxyquinolin-3-yl)-2-(naphthalen-2-yl)-1-phenylbutan-2-ol
分子式 C32H32N2O2
分子量 476.6
InChI
InChI Key
Canonical SMILES O[C@](CCN(C)C)(C1=CC=C2C=CC=CC2=C1)[C@@H](C3=CC4=CC=CC=C4N=C3OC)C5=CC=CC=C5

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
Bedaquiline Des-Bromo Impurity is chemically (1R,2S)-4-(Dimethylamino)-1-(2-methoxyquinolin-3-yl)-2-(naphthalen-2-yl)-1-phenylbutan-2-ol. Bedaquiline Des-Bromo Impurity is supplied with detailed characterization data compliant with regulatory guideline. Bedaquiline Des-Bromo 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 Bedaquiline. 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.