Vitas-M small molecule compound
1-[3-(4-fluorophenyl)-1-hydroxy-11-(3-nitrophenyl)-2,3,4,11-tetrahydro-10H-dibenzo[b,e][1,4]diazepin-10-yl]hexan-1-one
Catalog ID
STK559076
SMILES CCCCCC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)c2ccc(cc2)F)C1c1cccc(c1)[N+](=O)[O-]
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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 C31H30FN3O4 MW 527.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30FN3O4/c1-2-3-4-12-29(37)34-27-11-6-5-10-25(27)33-26-18-22(20-13-15-23(32)16-14-20)19-28(36)30(26)31(34)21-8-7-9-24(17-21)35(38)39/h5-11,13-17,22,31,36H,2-4,12,18-19H2,1H3InChIKey
JVQPQRRIROLYSC-UHFFFAOYSA-NSynonyms
1(3(4fluorophenyl)1hydroxy11(3nitrophenyl)23411tetrahydro10Hdibenzo(be)(14)diazepin10yl)hexan1one
CCCCCC(=O)N1c2ccccc2N=C2C(=C(O)CC(C2)c2ccc(cc2)F)C1c1cccc(c1)(N+)(=O)(O)
MFCD03816329
ZINC000102641096
ZINC000102641103
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