Lapaquistat

CAS

189059-71-0

Catalog Number

ACM189059710

Category

Other Products

Molecular Formula

C31H39ClN2O8

MSDS COA Spec Sheet

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Specification

Synonyms

Lapaquistat [INN], UNII-PEZ79BV72X, 189059-71-0, 2-(1-(2-((3R,5S)-1-(3-hydroxy-2,2-dimethylpropyl)-7-chloro-5-(2,3- dimethoxyphenyl)-2-oxo-1,2,3,5-tetrahydrobenzo(E)(1,4)oxazepin-3-yl)acetyl)piperidin-4-yl)acetic acid, 4-Piperidineacetic acid, 1-(((3R,5S)-1-(3-(hydroxy)-2,2-dimethylpropyl)-7-chloro-5-(2,3-dimethoxyphenyl)-1,2,3,5-tetrahydro-2-oxo-4,1-benzoxazepin-3-yl)acetyl)-

IUPAC Name

2-[1-[2-[(3R)-7-chloro-5-(2,3-dimethoxyphenyl)-1-(3-hydroxy-2,2-dimethylpropyl)-2-oxo-5H-4,1-benzoxazepin-3-yl]acetyl]piperidin-4-yl]acetic acid

Canonical SMILES

CC(C)(CN1C2=C(C=C(C=C2)Cl)C(OC(C1=O)CC(=O)N3CCC(CC3)CC(=O)O)C4=C(C(=CC=C4)OC)OC)CO

InChI Key

HDGUKVZPMPJBFK-RXVAYIKUSA-N

Boiling Point

824.024ºC at 760 mmHg

Flash Point

452.154ºC

Density

1.261g/cm³