Vitas-M small molecule compound
10-(cyclopropylcarbonyl)-11-(4-fluorophenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK087415
SMILES Fc1ccc(cc1)C1C2=C(Nc3c(N1C(=O)C1CC1)cccc3)CC(CC2=O)(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 C25H25FN2O2 MW 404.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25FN2O2/c1-25(2)13-19-22(21(29)14-25)23(15-9-11-17(26)12-10-15)28(24(30)16-7-8-16)20-6-4-3-5-18(20)27-19/h3-6,9-12,16,23,27H,7-8,13-14H2,1-2H3InChIKey
INBARELUFGZXRM-UHFFFAOYSA-NSynonyms
10(cyclopropylcarbonyl)11(4fluorophenyl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
5(cyclopropanecarbonyl)6(4fluorophenyl)99dimethyl681011tetrahydrobenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(N(C3=CC=CC=C3N2)C(=O)C4CC4)C5=CC=C(C=C5)F)C(=O)C1)C
Fc1ccc(cc1)C1C2=C(Nc3c(N1C(=O)C1CC1)cccc3)CC(CC2=O)(C)C
InChI=1SC25H25FN2O2c125(2)131922(21(29)1425)23(1591117(26)121015)28(24(30)167816)20643518(20)2719h36912162327H781314H212H3
MFCD01957280
STK087415
ZINC000001217425
ZINC000001217426
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