Vitas-M small molecule compound

2-{2-[4-(diphenylmethyl)piperazin-1-yl]-2-oxoethyl}hexahydro-1H-isoindole-1,3(2H)-dione

Catalog ID
STK008080
SMILES O=C(N1CCN(CC1)C(c1ccccc1)c1ccccc1)CN1C(=O)C2C(C1=O)CCCC2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C27H31N3O3 MW 445.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N3O3/c31-24(19-30-26(32)22-13-7-8-14-23(22)27(30)33)28-15-17-29(18-16-28)25(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-6,9-12,22-23,25H,7-8,13-19H2
InChIKey
UBNNWHDVXJNJDC-UHFFFAOYSA-N
Synonyms
500275-86-5
(3AR7AS)2(2(4(DIPHENYLMETHYL)PIPERAZIN1YL)2OXOETHYL)HEXAHYDRO1HISOINDOLE13(2H)DIONE
2(2(4(DIPHENYLMETHYL)PIPERAZIN1YL)2OXOETHYL)HEXAHYDRO1HISOINDOLE13(2H)DIONE
2(2(4benzhydrylpiperazin1yl)2oxoethyl)3a45677ahexahydroisoindole13dione
2(2(4benzhydrylpiperazin1yl)2oxoethyl)hexahydro1Hisoindole13(2H)dione
500275865
C1CCC2C(C1)C(=O)N(C2=O)CC(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5
InChI=1SC27H31N3O3c3124(193026(32)2213781423(22)27(30)33)28151729(181628)25(2093141020)21115261221h16912222325H781319H2
MFCD03303212
O=C(N1CCN(CC1)C(c1ccccc1)c1ccccc1)CN1C(=O)C2C(C1=O)CCCC2
STK008080
ZINC000002354450
ZINC000100627018

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.