Vitas-M small molecule compound
11-(4-fluoro-3-phenoxyphenyl)-7-(phenylcarbonyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK051048
SMILES O=C(c1ccc2c(c1)NC1=C(C(N2)c2ccc(c(c2)Oc2ccccc2)F)C(=O)CCC1)c1ccccc1
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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 C32H25FN2O3 MW 504.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H25FN2O3/c33-24-16-14-21(19-29(24)38-23-10-5-2-6-11-23)31-30-26(12-7-13-28(30)36)34-27-18-22(15-17-25(27)35-31)32(37)20-8-3-1-4-9-20/h1-6,8-11,14-19,31,34-35H,7,12-13H2InChIKey
FABFMDSWQYJSTL-UHFFFAOYSA-NSynonyms
11(4fluoro3phenoxyphenyl)7(phenylcarbonyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
2benzoyl6(4fluoro3phenoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
C1CC2=C(C(NC3=C(N2)C=C(C=C3)C(=O)C4=CC=CC=C4)C5=CC(=C(C=C5)F)OC6=CC=CC=C6)C(=O)C1
InChI=1SC32H25FN2O3c3324161421(1929(24)3823105261123)313026(1271328(30)36)34271822(151725(27)3531)32(37)208314920h168111419313435H71213H2
MFCD08051104
O=C(c1ccc2c(c1)NC1=C(C(N2)c2ccc(c(c2)Oc2ccccc2)F)C(=O)CCC1)c1ccccc1
STK051048
ZINC000009435189
ZINC000009435190
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