467439-05-0

Basic information

• Product Name: 3-(2-{(R)-2-[(S)-2-((S)-4-Carboxy-2-isobutoxycarbonylamino-butyrylamino)-4-methyl-pentanoylamino]-3-mercapto-propionylamino}-ethyl)-benzoic acid methyl ester
• Synonyms: 3-(2-{(R)-2-[(S)-2-((S)-4-Carboxy-2-isobutoxycarbonylamino-butyrylamino)-4-methyl-pentanoylamino]-3-mercapto-propionylamino}-ethyl)-benzoic acid methyl ester
• CAS NO: 467439-05-0
• Molecular Weight: 624.756
• Mol File: 467439-05-0.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: 3-(2-{(R)-2-[(S)-2-((S)-4-Carboxy-2-isobutoxycarbonylamino-butyrylamino)-4-methyl-pentanoylamino]-3-mercapto-propionylamino}-ethyl)-benzoic acid methyl ester(CAS DataBase Reference)
• NIST Chemistry Reference: 3-(2-{(R)-2-[(S)-2-((S)-4-Carboxy-2-isobutoxycarbonylamino-butyrylamino)-4-methyl-pentanoylamino]-3-mercapto-propionylamino}-ethyl)-benzoic acid methyl ester(467439-05-0)
• EPA Substance Registry System: 3-(2-{(R)-2-[(S)-2-((S)-4-Carboxy-2-isobutoxycarbonylamino-butyrylamino)-4-methyl-pentanoylamino]-3-mercapto-propionylamino}-ethyl)-benzoic acid methyl ester(467439-05-0)

Safety Data

• Hazardous Substances Data: 467439-05-0(Hazardous Substances Data)

Upstream product

• 1129-28-8 3-methoxycarbonylbenzyl bromide 
• 68432-92-8 methyl 3-cyanomethylbenzoate 
• 99-36-5 1-methoxycarbonyl-3-methylbenzene 
• 35661-60-0 Fmoc-Leu-OH 
• 179003-00-0 3-(2-Amino-ethyl)-benzoic acid methyl ester 
• 135248-89-4 N^α-fluoren-9-ylmethoxycarbonyl-L-cysteine 

Relevant articles and documents

Phenethyl amides as novel noncovalent inhibitors of hepatitis C virus NS3/4A protease: Discovery, initial SAR, and molecular modeling

The discovery of novel, reversible and competitive tripeptide inhibitors of the Hepatitis C virus NS3/4A serine protease is described. These inhibitors are characterized by the presence of a C-terminal phenethyl amide group, which extends into the prime side of the enzyme. Initial SAR together with molecular modeling and data from site-directed mutagenesis suggest an interaction of the phenethyl amide group with Lys-136.