Vitas-M small molecule compound
1-[11-(3-bromophenyl)-1-hydroxy-3-(4-methylphenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]propan-1-one
Catalog ID
STK000729
SMILES CCC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)c2ccc(cc2)C)C1c1cccc(c1)Br
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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 C29H27BrN2O2 MW 515.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27BrN2O2/c1-3-27(34)32-25-10-5-4-9-23(25)31-24-16-21(19-13-11-18(2)12-14-19)17-26(33)28(24)29(32)20-7-6-8-22(30)15-20/h4-15,21,29,33H,3,16-17H2,1-2H3InChIKey
FWTDSECUVYLWPJ-UHFFFAOYSA-NSynonyms
1(11(3bromophenyl)1hydroxy3(4methylphenyl)23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)propan1one
1(11(3bromophenyl)1hydroxy3(ptolyl)34dihydro2Hdibenzo(be)(14)diazepin10(11H)yl)propan1one
CCC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)c2ccc(cc2)C)C1c1cccc(c1)Br
MFCD03194700
STK000729
ZINC000100426051
ZINC000100426063
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