Vitas-M small molecule compound
3-[6-hydroxy-3-oxo-1-(propan-2-yl)-2,3,4,5-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl]-7-methoxy-1-methylquinolin-2(1H)-one
Catalog ID
STL159326
SMILES COc1ccc2c(c1)n(C)c(=O)c(c2)C1CC(=Nc2c1c(=O)[nH]n2C(C)C)O
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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 C20H22N4O4 MW 382.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O4/c1-10(2)24-18-17(19(26)22-24)13(9-16(25)21-18)14-7-11-5-6-12(28-4)8-15(11)23(3)20(14)27/h5-8,10,13H,9H2,1-4H3,(H,21,25)(H,22,26)InChIKey
HUTQSLGAGVYZLE-UHFFFAOYSA-NSynonyms
1310940-86-31310940863
3(6hydroxy3oxo1(propan2yl)2345tetrahydro1Hpyrazolo(34b)pyridin4yl)7methoxy1methylquinolin2(1H)one
4(7methoxy1methyl2oxoquinolin3yl)1propan2yl2457tetrahydropyrazolo(34b)pyridine36dione
CC(C)N1C2=C(C(CC(=O)N2)C3=CC4=C(C=C(C=C4)OC)N(C3=O)C)C(=O)N1
COc1ccc2c(c1)n(C)c(=O)c(c2)C1CC(=Nc2c1c(=O)(nH)n2C(C)C)O
InChI=1SC20H22N4O4c110(2)241817(19(26)2224)13(916(25)2118)147115612(284)815(11)23(3)20(14)27h581013H9H214H3(H2125)(H2226)
MFCD20758655
ZINC000071283800
ZINC000071283801
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