Vitas-M small molecule compound

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

Catalog ID
STK047367
SMILES CCC(=O)N1C(C2=C(Nc3c1cccc3)CC(CC2=O)c1ccccc1)c1ccccc1OCc1ccccc1

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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 C35H32N2O3 MW 528.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H32N2O3/c1-2-33(39)37-30-19-11-10-18-28(30)36-29-21-26(25-15-7-4-8-16-25)22-31(38)34(29)35(37)27-17-9-12-20-32(27)40-23-24-13-5-3-6-14-24/h3-20,26,35-36H,2,21-23H2,1H3
InChIKey
KFWHLJAZLWQBRL-UHFFFAOYSA-N
Synonyms

11(2(benzyloxy)phenyl)3phenyl10propanoyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
11(2(benzyloxy)phenyl)3phenyl10propionyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9phenyl6(2phenylmethoxyphenyl)5propanoyl891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CCC(=O)N1C(C2=C(CC(CC2=O)C3=CC=CC=C3)NC4=CC=CC=C41)C5=CC=CC=C5OCC6=CC=CC=C6
CCC(=O)N1C(C2=C(Nc3c1cccc3)CC(CC2=O)c1ccccc1)c1ccccc1OCc1ccccc1
InChI=1SC35H32N2O3c1233(39)37301911101828(30)36292126(25157481625)2231(38)34(29)35(37)27179122032(27)402324135361424h320263536H22123H21H3
MFCD01957529
STK047367
ZINC000018105960
ZINC000018105968

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Available files

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