159565-69-2

Basic information

• Product Name: [(2R,3R)-1,1-dioxo-2-propan-2-yl-thiolan-3-yl] N-[(2S,3R)-3-hydroxy-4- [(2S)-4-[(3-hydroxyphenyl)methyl]-2-(tert-butylcarbamoyl)piperazin-1-y l]-1-phenyl-butan-2-yl]carbamate
• Synonyms: [(2R,3R)-1,1-dioxo-2-propan-2-yl-thiolan-3-yl] N-[(2S,3R)-3-hydroxy-4- [(2S)-4-[(3-hydroxyphenyl)methyl]-2-(tert-butylcarbamoyl)piperazin-1-y l]-1-phenyl-butan-2-yl]carbamate
• CAS NO: 159565-69-2
• Molecular Formula: C34H50N4O7S
• Molecular Weight: 658.85
• Mol File: 159565-69-2.mol
• Article Data: 0

Chemical Properties

• Boiling Point: 880.9°Cat760mmHg
• Flash Point: 486.6°C
• Appearance: /
• Density: 1.28g/cm³
• Vapor Pressure: 3.12E-33mmHg at 25°C
• Refractive Index: 1.61
• PKA: 9.95±0.10(Predicted)
• CAS DataBase Reference: [(2R,3R)-1,1-dioxo-2-propan-2-yl-thiolan-3-yl] N-[(2S,3R)-3-hydroxy-4- [(2S)-4-[(3-hydroxyphenyl)methyl]-2-(tert-butylcarbamoyl)piperazin-1-y l]-1-phenyl-butan-2-yl]carbamate(CAS DataBase Reference)
• NIST Chemistry Reference: [(2R,3R)-1,1-dioxo-2-propan-2-yl-thiolan-3-yl] N-[(2S,3R)-3-hydroxy-4- [(2S)-4-[(3-hydroxyphenyl)methyl]-2-(tert-butylcarbamoyl)piperazin-1-y l]-1-phenyl-butan-2-yl]carbamate(159565-69-2)
• EPA Substance Registry System: [(2R,3R)-1,1-dioxo-2-propan-2-yl-thiolan-3-yl] N-[(2S,3R)-3-hydroxy-4- [(2S)-4-[(3-hydroxyphenyl)methyl]-2-(tert-butylcarbamoyl)piperazin-1-y l]-1-phenyl-butan-2-yl]carbamate(159565-69-2)

Safety Data

• Hazardous Substances Data: 159565-69-2(Hazardous Substances Data)

Usage

General Description

The chemical "[(2R,3R)-1,1-dioxo-2-propan-2-yl-thiolan-3-yl] N-[(2S,3R)-3-hydroxy-4- [(2S)-4-[(3-hydroxyphenyl)methyl]-2-(tert-butylcarbamoyl)piperazin-1-y l]-1-phenyl-butan-2-yl]carbamate" is a complex compound with multiple functional groups. It contains a thiolane ring, a carbamate group, a piperazine ring, and a phenyl group. The compound also contains hydroxy and tert-butylcarbamoyl substituents. The stereochemistry of the compound is specified with the (2R,3R) and (2S,3R) prefixes, indicating the configuration of the chiral centers. [(2R,3R)-1,1-dioxo-2-propan-2-yl-thiolan-3-yl] N-[(2S,3R)-3-hydroxy-4- [(2S)-4-[(3-hydroxyphenyl)methyl]-2-(tert-butylcarbamoyl)piperazin-1-y l]-1-phenyl-butan-2-yl]carbamate likely has pharmaceutical or biological applications due to the presence of a piperazine ring and hydroxyphenyl group, which are common moieties in drug molecules.

InChI:InChI=1/C34H50N4O7S/c1-23(2)31-30(14-17-46(31,43)44)45-33(42)35-27(19-24-10-7-6-8-11-24)29(40)22-38-16-15-37(20-25-12-9-13-26(39)18-25)21-28(38)32(41)36-34(3,4)5/h6-13,18,23,27-31,39-40H,14-17,19-22H2,1-5H3,(H,35,42)(H,36,41)/t27-,28-,29+,30+,31+/m0/s1