Vitas-M small molecule compound
7,7-dimethyl-4-(3-phenoxyphenyl)-2-phenyl-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione
Catalog ID
STK332660
SMILES O=C1CC(C)(C)CC2=C1C(c1cccc(c1)Oc1ccccc1)c1c(N2)[nH]n(c1=O)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 C30H27N3O3 MW 477.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N3O3/c1-30(2)17-23-26(24(34)18-30)25(19-10-9-15-22(16-19)36-21-13-7-4-8-14-21)27-28(31-23)32-33(29(27)35)20-11-5-3-6-12-20/h3-16,25,31-32H,17-18H2,1-2H3InChIKey
QUTCSFQQCFJICS-UHFFFAOYSA-NSynonyms
77dimethyl4(3phenoxyphenyl)2phenyl4689tetrahydro1Hpyrazolo(34b)quinoline35dione
77dimethyl4(3phenoxyphenyl)2phenyl4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
CC1(CC2=C(C(C3=C(N2)NN(C3=O)C4=CC=CC=C4)C5=CC(=CC=C5)OC6=CC=CC=C6)C(=O)C1)C
InChI=1SC30H27N3O3c130(2)172326(24(34)1830)25(191091522(1619)3621137481421)2728(3123)3233(29(27)35)20115361220h316253132H1718H212H3
MFCD09962814
O=C1CC(C)(C)CC2=C1C(c1cccc(c1)Oc1ccccc1)c1c(N2)(nH)n(c1=O)c1ccccc1
ZINC000102449818
ZINC000102449821
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