Vitas-M small molecule compound

2-(4-methylphenyl)-2-oxoethyl 1,3-dioxo-2-(quinolin-5-yl)-2,3-dihydro-1H-isoindole-5-carboxylate

Catalog ID
STK545263
SMILES Cc1ccc(cc1)C(=O)COC(=O)c1ccc2c(c1)C(=O)N(C2=O)c1cccc2c1cccn2

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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 C27H18N2O5 MW 450.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H18N2O5/c1-16-7-9-17(10-8-16)24(30)15-34-27(33)18-11-12-19-21(14-18)26(32)29(25(19)31)23-6-2-5-22-20(23)4-3-13-28-22/h2-14H,15H2,1H3
InChIKey
QDJKPFAUXINJBJ-UHFFFAOYSA-N
Synonyms
356083-65-3
(2(4METHYLPHENYL)2OXIDANYLIDENEETHYL)13BIS(OXIDANYLIDENE)2QUINOLIN5YLISOINDOLE5CARBOXYLATE
(2(4METHYLPHENYL)2OXOETHYL)13DIOXO2QUINOLIN5YLISOINDOLE5CARBOXYLATE
13DIKETO2(5QUINOLYL)ISOINDOLINE5CARBOXYLICACID(2KETO2(PTOLYL)ETHYL)ESTER
13DIOXO2(5QUINOLINYL)5ISOINDOLECARBOXYLICACID(2(4METHYLPHENYL)2OXOETHYL)ESTER
13DIOXO2QUINOLIN5YL23DIHYDRO1HISOINDOLE5CARBOXYLICACID2OXO2PTOLYLETHYLESTER
2(4methylphenyl)2oxoethyl13dioxo2(quinolin5yl)23dihydro1Hisoindole5carboxylate
2(4METHYLPHENYL)2OXOETHYL13DIOXO2QUINOLIN5YLISOINDOLINE5CARBOXYLATE
2oxo2(ptolyl)ethyl13dioxo2(quinolin5yl)isoindoline5carboxylate
356083653
CC1=CC=C(C=C1)C(=O)COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)C4=CC=CC5=C4C=CC=N5
InChI=1SC27H18N2O5c1167917(10816)24(30)153427(33)1811121921(1418)26(32)29(25(19)31)236252220(23)43132822h214H15H21H3
MFCD02915897
ZINC000000991415
ZINC00991415
ZINC991415

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Available files

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