Vitas-M small molecule compound
11-(4-hydroxy-3,5-dimethoxyphenyl)-3-phenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK000176
SMILES COc1cc(cc(c1O)OC)C1Nc2ccccc2NC2=C1C(=O)CC(C2)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 C27H26N2O4 MW 442.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O4/c1-32-23-14-18(15-24(33-2)27(23)31)26-25-21(28-19-10-6-7-11-20(19)29-26)12-17(13-22(25)30)16-8-4-3-5-9-16/h3-11,14-15,17,26,28-29,31H,12-13H2,1-2H3InChIKey
FDVXNNIFAZBQQL-UHFFFAOYSA-NSynonyms
11(4hydroxy35dimethoxyphenyl)3phenyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
11(4HYDROXY35DIMETHOXYPHENYL)3PHENYL234TRIHYDRO5H10H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
6(4hydroxy35dimethoxyphenyl)9phenyl56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=CC(=CC(=C1O)OC)C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC5=CC=CC=C5N2
COc1cc(cc(c1O)OC)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1ccccc1
InChI=1SC27H26N2O4c132231418(1524(332)27(23)31)262521(281910671120(19)2926)1217(1322(25)30)168435916h31114151726282931H1213H212H3
MFCD02104487
STK000176
ZINC000000710624
ZINC000000710627
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