Vitas-M small molecule compound
(4S,7S)-4-(4-chlorophenyl)-2-phenyl-7-(3,4,5-trimethoxyphenyl)-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione
Catalog ID
STK334927
SMILES COc1c(OC)cc(cc1OC)[C@@H]1CC(=O)C2=C(C1)Nc1c([C@H]2c2ccc(cc2)Cl)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 C31H28ClN3O5 MW 558.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28ClN3O5/c1-38-24-15-19(16-25(39-2)29(24)40-3)18-13-22-27(23(36)14-18)26(17-9-11-20(32)12-10-17)28-30(33-22)34-35(31(28)37)21-7-5-4-6-8-21/h4-12,15-16,18,26,33-34H,13-14H2,1-3H3/t18-,26-/m0/s1InChIKey
ZQTFMRRVVNKSRN-QYBDOPJKSA-NSynonyms
(4S7S)4(4chlorophenyl)2phenyl7(345trimethoxyphenyl)146789hexahydropyrazolo(34b)quinoline35dione
(4S7S)4(4chlorophenyl)2phenyl7(345trimethoxyphenyl)4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
COC1=CC(=CC(=C1OC)OC)C2CC3=C(C(C4=C(N3)NN(C4=O)C5=CC=CC=C5)C6=CC=C(C=C6)Cl)C(=O)C2
COc1c(OC)cc(cc1OC)(C@@H)1CC(=O)C2=C(C1)Nc1c((C@H)2c2ccc(cc2)Cl)c(=O)n((nH)1)c1ccccc1
InChI=1SC31H28ClN3O5c138241519(1625(392)29(24)403)18132227(23(36)1418)26(1791120(32)121017)2830(3322)3435(31(28)37)217546821h412151618263334H1314H213H3t1826m0s1
MFCD13368768
ZINC000102051331
ZINC102051331
Check stock
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Check stock on Vitas-MAvailable files
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