169168-47-2

Basic information

• Product Name: (3aR,6S,7aS)-5-[(2R,3S)-3-{[N-acetyl-3-(quinolin-8-ylsulfonyl)-D-alanyl]amino}-2-hydroxy-4-phenylbutyl]-N-tert-butyloctahydrothieno[3,2-c]pyridine-6-carboxamide
• Synonyms: thieno[3,2-c]pyridine-6-carboxamide, 5-[(2R,3S)-3-[[(2S)-2-(acetylamino)-1-oxo-3-(8-quinolinylsulfonyl)propyl]amino]-2-hydroxy-4-phenylbutyl]-N-(1,1-dimethylethyl)octahydro-, (3aR,6S,7aS)-
• CAS NO: 169168-47-2
• Molecular Formula: C₃₆H₄₇N₅O₆S₂
• Molecular Weight: 709.9183
• Mol File: 169168-47-2.mol
• Article Data: 0

Chemical Properties

• Boiling Point: 1035.7°C at 760 mmHg
• Flash Point: 580.2°C
• Density: 1.27g/cm³
• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.608
• PKA: 13.80±0.46(Predicted)
• CAS DataBase Reference: (3aR,6S,7aS)-5-[(2R,3S)-3-{[N-acetyl-3-(quinolin-8-ylsulfonyl)-D-alanyl]amino}-2-hydroxy-4-phenylbutyl]-N-tert-butyloctahydrothieno[3,2-c]pyridine-6-carboxamide(CAS DataBase Reference)
• NIST Chemistry Reference: (3aR,6S,7aS)-5-[(2R,3S)-3-{[N-acetyl-3-(quinolin-8-ylsulfonyl)-D-alanyl]amino}-2-hydroxy-4-phenylbutyl]-N-tert-butyloctahydrothieno[3,2-c]pyridine-6-carboxamide(169168-47-2)
• EPA Substance Registry System: (3aR,6S,7aS)-5-[(2R,3S)-3-{[N-acetyl-3-(quinolin-8-ylsulfonyl)-D-alanyl]amino}-2-hydroxy-4-phenylbutyl]-N-tert-butyloctahydrothieno[3,2-c]pyridine-6-carboxamide(169168-47-2)

Safety Data

• Hazardous Substances Data: 169168-47-2(Hazardous Substances Data)

Usage

Description

(3aR,6S,7aS)-5-[(2R,3S)-3-[N-acetyl-3-(quinolin-8-ylsulfonyl)-D-alanyl]amino-2-hydroxy-4-phenylbutyl]-N-tert-butyloctahydrothieno[3,2-c]pyridine-6-carboxamide is a complex chiral molecule with a thieno[3,2-c]pyridine core structure. It features a quinolin-8-ylsulfonyl group, a D-alanyl amino acid moiety, a hydroxy and a phenylbutyl substituent, an N-acetyl group, and a tert-butyloctahydrocarboxamide moiety. The presence of multiple stereocenters and its unique structure suggest potential biological activity or pharmaceutical applications.

Uses

Used in Pharmaceutical Industry:
(3aR,6S,7aS)-5-[(2R,3S)-3-[N-acetyl-3-(quinolin-8-ylsulfonyl)-D-alanyl]amino-2-hydroxy-4-phenylbutyl]-N-tert-butyloctahydrothieno[3,2-c]pyridine-6-carboxamide is used as a potential pharmaceutical candidate for [specific application reason, if known]. Its unique structure and multiple stereocenters may contribute to its biological activity and potential therapeutic effects.
Used in Research and Development:
(3aR,6S,7aS)-5-[(2R,3S)-3-[N-acetyl-3-(quinolin-8-ylsulfonyl)-D-alanyl]amino-2-hydroxy-4-phenylbutyl]-N-tert-butyloctahydrothieno[3,2-c]pyridine-6-carboxamide is used as a subject of research and development for understanding its properties, potential applications, and mechanisms of action. Further studies may reveal its potential uses in various fields, such as drug discovery or chemical synthesis.
Note: The specific application reason in the Pharmaceutical Industry section is left blank as the provided materials do not specify the exact use of the compound. Further research and analysis would be required to determine its potential applications in the pharmaceutical field.