1219835-18-3

Basic information

• Product Name: (3S)-N-[Boc-S-(p-methylbenzyl)-L-cysteinyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid methyl ester
• Synonyms: (3S)-N-[Boc-S-(p-methylbenzyl)-L-cysteinyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid methyl ester
• CAS NO: 1219835-18-3
• Molecular Weight: 498.643
• Mol File: 1219835-18-3.mol
• Article Data: 1

Chemical Properties

• CAS DataBase Reference: (3S)-N-[Boc-S-(p-methylbenzyl)-L-cysteinyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid methyl ester(CAS DataBase Reference)
• NIST Chemistry Reference: (3S)-N-[Boc-S-(p-methylbenzyl)-L-cysteinyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid methyl ester(1219835-18-3)
• EPA Substance Registry System: (3S)-N-[Boc-S-(p-methylbenzyl)-L-cysteinyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid methyl ester(1219835-18-3)

Safety Data

• Hazardous Substances Data: 1219835-18-3(Hazardous Substances Data)

Upstream product

• 61925-77-7 Boc-cysteine(4-Me-Bn) 
• 79815-19-3 methyl (3S)-1,2,3,4-tetrahydro-3-isoquinolinecarboxylate 

Downstream Products

• 1219835-21-8 (3S)-N-[Boc-S-(p-methylbenzyl)-L-cysteinyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid 

Relevant articles and documents

2,3-Diamino acid modifying 3S-tetrahydroisoquinoline-3-carboxylic acids: Leading to a class of novel agents with highly unfolded conformation, selective in vitro anti-platelet aggregation and potent in vivo anti-thrombotic activity

In the preparation of anti-thrombotic agents the 2- and 3-positions of 3S-tetra-hydroisoquinoline-3-carboxylic acid (THIQA) were simultaneously modified with amino acids to form 20 novel N-(3S-N-aminoacyl-1,2,3,4-tetrahydroisoquinoline-3-carbonyl)amino acids (8a-t). On an in vitro platelet aggregation model 8a-t selectively inhibit ADP-induced platelet aggregation and their IC50 values are leas than 3.5 nM. On an extracorporeal circulation of arterioveinos cannula model of rats both orally and intraveously effective doses of 8a-t are less than 30 nmol/kg. Cerius2 based stereoview of explores 8a-t having highly unfolded conformation. 3D QSAR analysis gives the importance of the unfolded conformation to high in vitro anti-platelet aggregation and in vivo anti-thrombotic potency rational understanding.