Pibrentasvir Impurity 1 CAS#: 2412432-58-5

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

Identification

英文名 Pibrentasvir Impurity 1
分子结构
CAS编号 2412432-58-5
EINECS Number
MDL Number
Beilstein Registry Number
别名 Methyl ((2S,3R)-1-((S)-2-(6-((2R,5R)-1-(3,5-difluoro-4-(4-(4-fluorophenyl)piperidin-1-yl)phenyl)-5-(5-fluoro-2-((R)-1-(N-(methoxycarbonyl)-O-methyl-L-threonyl)pyrrolidin-2-yl)-1H-benzo[d]imidazol-6-yl)pyrrolidin-2-yl)-5-fluoro-1H-benzo[d]imidazol-2-yl)pyrrolidin-1-yl)-3-methoxy-1-oxobutan-2-yl)carbamate
分子式 C57H65F5N10O8
分子量 1113.2
InChI
InChI Key
Canonical SMILES FC1=C(C=C(NC([C@H](CCC2)N2C([C@H]([C@@H](C)OC)NC(OC)=O)=O)=N3)C3=C1)[C@@H]4N(C5=CC(F)=C(N6CCC(C(C=C7)=CC=C7F)CC6)C(F)=C5)[C@@H](C(C=C(NC([C@@H](CCC8)N8C([C@H]([C@@H](C)OC)NC(OC)=O)=O)=N9)C9=C%10)=C%10F)CC4

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
Pibrentasvir Impurity 1 is chemically Methyl ((2S,3R)-1-((S)-2-(6-((2R,5R)-1-(3,5-difluoro-4-(4-(4-fluorophenyl)piperidin-1-yl)phenyl)-5-(5-fluoro-2-((R)-1-(N-(methoxycarbonyl)-O-methyl-L-threonyl)pyrrolidin-2-yl)-1H-benzo[d]imidazol-6-yl)pyrrolidin-2-yl)-5-fluoro-1H-benzo[d]imidazol-2-yl)pyrrolidin-1-yl)-3-methoxy-1-oxobutan-2-yl)carbamate. Pibrentasvir Impurity 1 is supplied with detailed characterization data compliant with regulatory guideline. Pibrentasvir 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 Pibrentasvir. 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.

Di-BOC-Benzimidazole CAS#: N/A

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

Identification

英文名 Di-BOC-Benzimidazole
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 Di-tert-butyl 2,2′-(((2R,5R)-1-(3,5-difluoro-4-(4-(4-fluorophenyl)piperidin-1-yl)phenyl)pyrrolidine-2,5-diyl)bis(6-fluoro-1H-benzo[d]imidazole-5,2-diyl))(2S,2’S)-bis(pyrrolidine-1-carboxylate)
分子式 C53H59F5N8O4
分子量 967.1
InChI
InChI Key
Canonical SMILES FC1=CC=C(C2CCN(C3=C(F)C=C(N4[C@@H](C5=C(F)C=C6C(N=C([C@H]7N(C(OC(C)(C)C)=O)CCC7)N6)=C5)CC[C@@H]4C8=C(F)C=C9C(N=C([C@H]%10N(C(OC(C)(C)C)=O)CCC%10)N9)=C8)C=C3F)CC2)C=C1

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
Di-BOC-Benzimidazole is chemically Di-tert-butyl 2,2′-(((2R,5R)-1-(3,5-difluoro-4-(4-(4-fluorophenyl)piperidin-1-yl)phenyl)pyrrolidine-2,5-diyl)bis(6-fluoro-1H-benzo[d]imidazole-5,2-diyl))(2S,2’S)-bis(pyrrolidine-1-carboxylate). Di-BOC-Benzimidazole is supplied with detailed characterization data compliant with regulatory guideline. Di-BOC-Benzimidazole 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 Pibrentasvir. 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.

Pibrentasvir CAS#: 1353900-92-1

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

Identification

英文名 Pibrentasvir
分子结构
CAS编号 1353900-92-1
EINECS Number
MDL Number
Beilstein Registry Number
别名 Dimethyl ((2S,2’S,3R,3’R)-((2S,2’S)-(((2R,5R)-1-(3,5-difluoro-4-(4-(4-fluorophenyl)piperidin-1-yl)phenyl)pyrrolidine-2,5-diyl)bis(5-fluoro-1H-benzo[d]imidazole-6,2-diyl))bis(pyrrolidine-2,1-diyl))bis(3-methoxy-1-oxobutane-1,2-diyl))dicarbamate
分子式 C57H65F5N10O8
分子量 1113.2
InChI
InChI Key
Canonical SMILES FC1=C([C@@H]2N(C3=CC(F)=C(N4CCC(C5=CC=C(F)C=C5)CC4)C(F)=C3)[C@@H](C(C=C(NC([C@H](CCC6)N6C([C@H]([C@@H](C)OC)NC(OC)=O)=O)=N7)C7=C8)=C8F)CC2)C=C9C(N=C([C@H](CCC%10)N%10C([C@H]([C@@H](C)OC)NC(OC)=O)=O)N9)=C1

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
Pibrentasvir is chemically Dimethyl ((2S,2’S,3R,3’R)-((2S,2’S)-(((2R,5R)-1-(3,5-difluoro-4-(4-(4-fluorophenyl)piperidin-1-yl)phenyl)pyrrolidine-2,5-diyl)bis(5-fluoro-1H-benzo[d]imidazole-6,2-diyl))bis(pyrrolidine-2,1-diyl))bis(3-methoxy-1-oxobutane-1,2-diyl))dicarbamate. Pibrentasvir is supplied with detailed characterization data compliant with regulatory guideline. Pibrentasvir 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 Pibrentasvir. 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.

Desfluoro Pibrenstavir 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 Desfluoro Pibrenstavir Impurity
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 Dimethyl ((2S,2’S,3R,3’R)-((2S,2’S)-(((2R,5R)-1-(3,5-difluoro-4-(4-phenylpiperidin-1-yl)phenyl)pyrrolidine-2,5-diyl)bis(6-fluoro-1H-benzo[d]imidazole-5,2-diyl))bis(pyrrolidine-2,1-diyl))bis(3-methoxy-1-oxobutane-1,2-diyl))dicarbamate
分子式 C57H66F4N10O8
分子量 1095.2
InChI
InChI Key
Canonical SMILES O=C(OC)N[C@@H]([C@H](OC)C)C(N1[C@H](C2=NC3=CC([C@@H]4N(C5=CC(F)=C(N6CCC(C7=CC=CC=C7)CC6)C(F)=C5)[C@@H](C8=C(F)C=C9C(N=C([C@H]%10N(C([C@H]([C@H](OC)C)NC(OC)=O)=O)CCC%10)N9)=C8)CC4)=C(F)C=C3N2)CCC1)=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
Desfluoro Pibrenstavir Impurity is chemically Dimethyl ((2S,2’S,3R,3’R)-((2S,2’S)-(((2R,5R)-1-(3,5-difluoro-4-(4-phenylpiperidin-1-yl)phenyl)pyrrolidine-2,5-diyl)bis(6-fluoro-1H-benzo[d]imidazole-5,2-diyl))bis(pyrrolidine-2,1-diyl))bis(3-methoxy-1-oxobutane-1,2-diyl))dicarbamate. Desfluoro Pibrenstavir Impurity is supplied with detailed characterization data compliant with regulatory guideline. Desfluoro Pibrenstavir 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 Pibrentasvir. 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.

Benzimidazole CAS#: N/A

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

Identification

英文名 Benzimidazole
分子结构
CAS编号 N/A
EINECS Number
MDL Number
Beilstein Registry Number
别名 5,5′-((2R,5R)-1-(3,5-difluoro-4-(4-(4-fluorophenyl)piperidin-1-yl)phenyl)pyrrolidine-2,5-diyl)bis(6-fluoro-2-((S)-pyrrolidin-2-yl)-1H-benzo[d]imidazole)
分子式 C43H43F5N8
分子量 766.9
InChI
InChI Key
Canonical SMILES FC1=CC=C(C2CCN(C3=C(F)C=C(N4[C@@H](C5=C(F)C=C6C(N=C([C@H]7NCCC7)N6)=C5)CC[C@@H]4C8=C(F)C=C9C(N=C([C@H]%10NCCC%10)N9)=C8)C=C3F)CC2)C=C1

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
Benzimidazole is chemically 5,5′-((2R,5R)-1-(3,5-difluoro-4-(4-(4-fluorophenyl)piperidin-1-yl)phenyl)pyrrolidine-2,5-diyl)bis(6-fluoro-2-((S)-pyrrolidin-2-yl)-1H-benzo[d]imidazole). Benzimidazole is supplied with detailed characterization data compliant with regulatory guideline. Benzimidazole 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 Pibrentasvir. 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.