Vitas-M small molecule compound
4-(4-hydroxy-3-iodo-5-methoxyphenyl)-2-phenyl-4,7,8,9-tetrahydro-1H-pyrazolo[3,4-b]quinoline-3,5(2H,6H)-dione
Catalog ID
STK333443
SMILES COc1cc(cc(c1O)I)C1C2=C(CCCC2=O)Nc2c1c(=O)n([nH]2)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 C23H20IN3O4 MW 529.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20IN3O4/c1-31-17-11-12(10-14(24)21(17)29)18-19-15(8-5-9-16(19)28)25-22-20(18)23(30)27(26-22)13-6-3-2-4-7-13/h2-4,6-7,10-11,18,25-26,29H,5,8-9H2,1H3InChIKey
JHOYBCRJWWZQCN-UHFFFAOYSA-NSynonyms
4(4hydroxy3iodo5methoxyphenyl)2phenyl146789hexahydropyrazolo(34b)quinoline35dione
4(4hydroxy3iodo5methoxyphenyl)2phenyl4789tetrahydro1Hpyrazolo(34b)quinoline35(2H6H)dione
COC1=C(C(=CC(=C1)C2C3=C(CCCC3=O)NC4=C2C(=O)N(N4)C5=CC=CC=C5)I)O
COc1cc(cc(c1O)I)C1C2=C(CCCC2=O)Nc2c1c(=O)n((nH)2)c1ccccc1
InChI=1SC23H20IN3O4c131171112(1014(24)21(17)29)181915(85916(19)28)252220(18)23(30)27(2622)136324713h2467101118252629H589H21H3
MFCD09910513
ZINC000102046310
ZINC000102046313
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