2-(1-(2-((3R,5S)-1-(3-Acetoxy-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, 98%

cas: 189060-13-7 — see every product listed under this CAS number, including other names

2-(1-(2-((3R,5S)-1-(3-Acetoxy-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, 98% (CAS 189060-13-7) is a chemical reagent available from Chemat. Available pack sizes: 1mg, 5mg, 10mg, 25mg. Offered by: Chemat.

• 2D
• 3D

Tak-475 is an organonitrogen heterocyclic compound and an oxacycle.

Source: ChEBI

Identity

Molecular formula	C33H41ClN2O9
Molecular weight	645.1 g/mol
IUPAC name	2-[1-[2-[(3R,5S)-1-(3-acetyloxy-2,2-dimethylpropyl)-7-chloro-5-(2,3-dimethoxyphenyl)-2-oxo-5H-4,1-benzoxazepin-3-yl]acetyl]piperidin-4-yl]acetic acid
InChIKey	CMLUGNQVANVZHY-POURPWNDSA-N
SMILES	CC(=O)OCC(C)(C)CN1C2=C(C=C(C=C2)Cl)[C@H](O[C@@H](C1=O)CC(=O)N3CCC(CC3)CC(=O)O)C4=C(C(=CC=C4)OC)OC

Computed by PubChem (NCBI)

Synonyms: Lapaquistat acetate, Lapaquistat Acetate (TAK-475), Lapaquistat acetate [USAN], Lapaquistat acetate [USAN:JAN], orb1707099, Lapaquistat acetate (JAN/USAN), LAPAQUISTAT ACETATE [JAN]

Isomers (same molecular formula)

methyl (1R,15S,17R,18R,19S,20S)-6,18-dimethoxy-17-(3,4,5-trimethoxybenzoyl)oxy-1,3,11,12,14,15,16,17,18,19,20,21-dodecahydroyohimban-19-carboxylate;hydrochloride C₃₃H₄₁ClN₂O₉