Vitas-M small molecule compound
11-(4-hydroxy-3,5-dimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK043482
SMILES COc1cc(cc(c1O)OC)C1Nc2ccccc2NC2=C1C(=O)CCC2
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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 C21H22N2O4 MW 366.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O4/c1-26-17-10-12(11-18(27-2)21(17)25)20-19-15(8-5-9-16(19)24)22-13-6-3-4-7-14(13)23-20/h3-4,6-7,10-11,20,22-23,25H,5,8-9H2,1-2H3InChIKey
HQNCECFVELIWLJ-UHFFFAOYSA-NSynonyms
11(4hydroxy35dimethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(4hydroxy35dimethoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=CC(=CC(=C1O)OC)C2C3=C(CCCC3=O)NC4=CC=CC=C4N2
COc1cc(cc(c1O)OC)C1Nc2ccccc2NC2=C1C(=O)CCC2
InChI=1SC21H22N2O4c126171012(1118(272)21(17)25)201915(85916(19)24)2213634714(13)2320h3467101120222325H589H212H3
MFCD02917639
STK043482
ZINC000003904869
ZINC000003904870
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