Vitas-M small molecule compound

1-(4-chlorophenyl)-2-(4-methoxyphenyl)-3-phenyl-2H-benzo[f]isoindole-4,9-dione

Catalog ID
STK081765
SMILES COc1ccc(cc1)n1c(c2ccc(cc2)Cl)c2c(c1c1ccccc1)C(=O)c1c(C2=O)cccc1

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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 C31H20ClNO3 MW 489.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H20ClNO3/c1-36-23-17-15-22(16-18-23)33-28(19-7-3-2-4-8-19)26-27(29(33)20-11-13-21(32)14-12-20)31(35)25-10-6-5-9-24(25)30(26)34/h2-18H,1H3
InChIKey
ALWXDXFRPHZHFT-UHFFFAOYSA-N
Synonyms
332019-92-8
1(4CHLOROPHENYL)2(4METHOXYPHENYL)3PHENYL2HBENZO(F)ISOINDOLE49DIONE
3(4CHLOROPHENYL)2(4METHOXYPHENYL)1PHENYLBENZO(F)ISOINDOLE49DIONE
332019928
COC1=CC=C(C=C1)N2C(=C3C(=C2C4=CC=C(C=C4)Cl)C(=O)C5=CC=CC=C5C3=O)C6=CC=CC=C6
COc1ccc(cc1)n1c(c2ccc(cc2)Cl)c2c(c1c1ccccc1)C(=O)c1c(C2=O)cccc1
InChI=1SC31H20ClNO3c13623171522(161823)3328(197324819)2627(29(33)20111321(32)141220)31(35)251065924(25)30(26)34h218H1H3
MFCD00290937
STK081765
ZINC000002260551
ZINC02260551
ZINC2260551

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Available files

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