Vitas-M small molecule compound
1-[11-(4-tert-butylphenyl)-1-hydroxy-3,3-dimethyl-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]propan-1-one
Catalog ID
STK569017
SMILES CCC(=O)N1C(c2ccc(cc2)C(C)(C)C)C2=C(O)CC(CC2=Nc2c1cccc2)(C)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 C28H34N2O2 MW 430.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H34N2O2/c1-7-24(32)30-22-11-9-8-10-20(22)29-21-16-28(5,6)17-23(31)25(21)26(30)18-12-14-19(15-13-18)27(2,3)4/h8-15,26,31H,7,16-17H2,1-6H3InChIKey
QQXFLCVXVIZOCK-UHFFFAOYSA-NSynonyms
1(11(4tertbutylphenyl)1hydroxy33dimethyl23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)propan1one
MFCD05727242
ZINC000102653683
ZINC000102653685
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