Vitas-M small molecule compound
4-(4-hydroxy-3-methoxy-5-nitrophenyl)-7,7-dimethyl-2-phenyl-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione
Catalog ID
STK333477
SMILES COc1cc(cc(c1O)[N+](=O)[O-])C1C2=C(Nc3c1c(=O)n([nH]3)c1ccccc1)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 C25H24N4O6 MW 476.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N4O6/c1-25(2)11-15-20(17(30)12-25)19(13-9-16(29(33)34)22(31)18(10-13)35-3)21-23(26-15)27-28(24(21)32)14-7-5-4-6-8-14/h4-10,19,26-27,31H,11-12H2,1-3H3InChIKey
JPEAZKBDVMNROQ-UHFFFAOYSA-NSynonyms
4(4hydroxy3methoxy5nitrophenyl)77dimethyl2phenyl4689tetrahydro1Hpyrazolo(34b)quinoline35dione
4(4hydroxy3methoxy5nitrophenyl)77dimethyl2phenyl4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
CC1(CC2=C(C(C3=C(N2)NN(C3=O)C4=CC=CC=C4)C5=CC(=C(C(=C5)OC)O)(N+)(=O)(O))C(=O)C1)C
COc1cc(cc(c1O)(N+)(=O)(O))C1C2=C(Nc3c1c(=O)n((nH)3)c1ccccc1)CC(CC2=O)(C)C
InChI=1SC25H24N4O6c125(2)111520(17(30)1225)19(13916(29(33)34)22(31)18(1013)353)2123(2615)2728(24(21)32)147546814h41019262731H1112H213H3
MFCD09963093
ZINC000018195881
ZINC000018195883
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