Vitas-M small molecule compound
4-(1,3-benzodioxol-5-yl)-7,7-dimethyl-2-phenyl-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione
Catalog ID
STK332661
SMILES O=C1CC(C)(C)CC2=C1C(c1ccc3c(c1)OCO3)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 C25H23N3O4 MW 429.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O4/c1-25(2)11-16-21(17(29)12-25)20(14-8-9-18-19(10-14)32-13-31-18)22-23(26-16)27-28(24(22)30)15-6-4-3-5-7-15/h3-10,20,26-27H,11-13H2,1-2H3InChIKey
PBYDCXRRYRNRAN-UHFFFAOYSA-NSynonyms
669725-61-54(13benzodioxol5yl)77dimethyl2phenyl4689tetrahydro1Hpyrazolo(34b)quinoline35dione
4(13benzodioxol5yl)77dimethyl2phenyl4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
669725615
CC1(CC2=C(C(C3=C(N2)NN(C3=O)C4=CC=CC=C4)C5=CC6=C(C=C5)OCO6)C(=O)C1)C
InChI=1SC25H23N3O4c125(2)111621(17(29)1225)20(14891819(1014)32133118)2223(2616)2728(24(22)30)156435715h310202627H1113H212H3
MFCD09962815
O=C1CC(C)(C)CC2=C1C(c1ccc3c(c1)OCO3)c1c(N2)(nH)n(c1=O)c1ccccc1
ZINC000018195217
ZINC000018195219
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