Vitas-M small molecule compound

3-(4-methylphenyl)-11-[4-(propan-2-yl)phenyl]-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK403504
SMILES Cc1ccc(cc1)C1CC(=O)C2=C(C1)Nc1ccccc1NC2c1ccc(cc1)C(C)C

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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 C29H30N2O MW 422.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O/c1-18(2)20-12-14-22(15-13-20)29-28-26(30-24-6-4-5-7-25(24)31-29)16-23(17-27(28)32)21-10-8-19(3)9-11-21/h4-15,18,23,29-31H,16-17H2,1-3H3
InChIKey
JLXYVCYEFVJUGG-UHFFFAOYSA-N
Synonyms

3(4methylphenyl)11(4(propan2yl)phenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(4methylphenyl)6(4propan2ylphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
CC1=CC=C(C=C1)C2CC3=C(C(NC4=CC=CC=C4N3)C5=CC=C(C=C5)C(C)C)C(=O)C2
InChI=1SC29H30N2Oc118(2)20121422(151320)292826(3024645725(24)3129)1623(1727(28)32)2110819(3)91121h41518232931H1617H213H3
MFCD03489358
ZINC000004150985
ZINC000004150998

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Available files

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