Vitas-M small molecule compound
3-(4-chlorophenyl)-11-(2,3,4-trimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK056437
SMILES COc1ccc(c(c1OC)OC)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccc(cc1)Cl
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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 C28H27ClN2O4 MW 490.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H27ClN2O4/c1-33-24-13-12-19(27(34-2)28(24)35-3)26-25-22(30-20-6-4-5-7-21(20)31-26)14-17(15-23(25)32)16-8-10-18(29)11-9-16/h4-13,17,26,30-31H,14-15H2,1-3H3InChIKey
BIJGBXKJZPATLT-UHFFFAOYSA-NSynonyms
3(4chlorophenyl)11(234trimethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
3(4CHLOROPHENYL)11(234TRIMETHOXYPHENYL)234TRIHYDRO5H10H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
9(4chlorophenyl)6(234trimethoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=C(C(=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=C(C=C4)Cl)NC5=CC=CC=C5N2)OC)OC
COc1ccc(c(c1OC)OC)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccc(cc1)Cl
InChI=1SC28H27ClN2O4c13324131219(27(342)28(24)353)262522(3020645721(20)3126)1417(1523(25)32)1681018(29)11916h41317263031H1415H213H3
MFCD01655650
STK056437
ZINC000000856557
ZINC000000856560
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