Vitas-M small molecule compound
1-{1-hydroxy-3-(4-methylphenyl)-11-[4-(propan-2-yloxy)phenyl]-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl}hexan-1-one
Catalog ID
STK086579
SMILES CCCCCC(=O)N1C(c2ccc(cc2)OC(C)C)C2=C(O)CC(CC2=Nc2c1cccc2)c1ccc(cc1)C
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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 C35H40N2O3 MW 536.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H40N2O3/c1-5-6-7-12-33(39)37-31-11-9-8-10-29(31)36-30-21-27(25-15-13-24(4)14-16-25)22-32(38)34(30)35(37)26-17-19-28(20-18-26)40-23(2)3/h8-11,13-20,23,27,35,38H,5-7,12,21-22H2,1-4H3InChIKey
OZACDOPQUQFHBE-UHFFFAOYSA-NSynonyms
1(1hydroxy3(4methylphenyl)11(4(propan2yloxy)phenyl)23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)hexan1one
CCCCCC(=O)N1C(c2ccc(cc2)OC(C)C)C2=C(O)CC(CC2=Nc2c1cccc2)c1ccc(cc1)C
MFCD03032618
STK086579
ZINC000101488993
ZINC000101488998
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