Vitas-M small molecule compound
(4S,7S)-7-(3,4-dimethoxyphenyl)-2-phenyl-4-(pyridin-3-yl)-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione
Catalog ID
STK335262
SMILES COc1ccc(cc1OC)[C@@H]1CC(=O)C2=C(C1)Nc1c([C@H]2c2cccnc2)c(=O)n([nH]1)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 C29H26N4O4 MW 494.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N4O4/c1-36-23-11-10-17(15-24(23)37-2)19-13-21-26(22(34)14-19)25(18-7-6-12-30-16-18)27-28(31-21)32-33(29(27)35)20-8-4-3-5-9-20/h3-12,15-16,19,25,31-32H,13-14H2,1-2H3/t19-,25-/m0/s1InChIKey
XXNXUKUCJDCAND-DFBJGRDBSA-NSynonyms
(4S7S)7(34dimethoxyphenyl)2phenyl4(pyridin3yl)4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
(4S7S)7(34dimethoxyphenyl)2phenyl4pyridin3yl146789hexahydropyrazolo(34b)quinoline35dione
COC1=C(C=C(C=C1)C2CC3=C(C(C4=C(N3)NN(C4=O)C5=CC=CC=C5)C6=CN=CC=C6)C(=O)C2)OC
COc1ccc(cc1OC)(C@@H)1CC(=O)C2=C(C1)Nc1c((C@H)2c2cccnc2)c(=O)n((nH)1)c1ccccc1
InChI=1SC29H26N4O4c13623111017(1524(23)372)19132126(22(34)1419)25(187612301618)2728(3121)3233(29(27)35)208435920h312151619253132H1314H212H3t1925m0s1
MFCD13368777
ZINC000018198559
ZINC18198559
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