Vitas-M small molecule compound

11-[4-(3,5-diphenyl-4,5-dihydro-1H-pyrazol-1-yl)phenyl]-3,3,7,8-tetramethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK792877
SMILES O=C1CC(C)(C)CC2=C1C(Nc1c(N2)cc(c(c1)C)C)c1ccc(cc1)N1N=C(CC1c1ccccc1)c1ccccc1

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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 C38H38N4O MW 566.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H38N4O/c1-24-19-31-32(20-25(24)2)40-37(36-33(39-31)22-38(3,4)23-35(36)43)28-15-17-29(18-16-28)42-34(27-13-9-6-10-14-27)21-30(41-42)26-11-7-5-8-12-26/h5-20,34,37,39-40H,21-23H2,1-4H3
InChIKey
ZCMAJAVBRDCUQE-UHFFFAOYSA-N
Synonyms

11(4(35diphenyl45dihydro1Hpyrazol1yl)phenyl)3378tetramethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(4(35diphenyl34dihydropyrazol2yl)phenyl)2399tetramethyl681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CC1=CC2=C(C=C1C)NC3=C(C(N2)C4=CC=C(C=C4)N5C(CC(=N5)C6=CC=CC=C6)C7=CC=CC=C7)C(=O)CC(C3)(C)C
InChI=1SC38H38N4Oc124193132(2025(24)2)4037(3633(3931)2238(34)2335(36)43)28151729(181628)4234(271396101427)2130(4142)26117581226h52034373940H2123H214H3
MFCD03690768
ZINC000102785000
ZINC000102785011

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Available files

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