Vitas-M small molecule compound
methyl 4-[6-hydroxy-3-oxo-1-(propan-2-yl)-2,3,4,5-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl]benzoate
Catalog ID
STL159397
SMILES COC(=O)c1ccc(cc1)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 C17H19N3O4 MW 329.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3O4/c1-9(2)20-15-14(16(22)19-20)12(8-13(21)18-15)10-4-6-11(7-5-10)17(23)24-3/h4-7,9,12H,8H2,1-3H3,(H,18,21)(H,19,22)InChIKey
LHKRCKYTYZGIKW-UHFFFAOYSA-NSynonyms
1310941-42-41310941424
CC(C)N1C2=C(C(CC(=O)N2)C3=CC=C(C=C3)C(=O)OC)C(=O)N1
COC(=O)c1ccc(cc1)C1CC(=Nc2c1c(=O)(nH)n2C(C)C)O
InChI=1SC17H19N3O4c19(2)201514(16(22)1920)12(813(21)1815)104611(7510)17(23)243h47912H8H213H3(H1821)(H1922)
methyl4(36dioxo1propan2yl2457tetrahydropyrazolo(34b)pyridin4yl)benzoate
methyl4(6hydroxy3oxo1(propan2yl)2345tetrahydro1Hpyrazolo(34b)pyridin4yl)benzoate
MFCD20758672
ZINC000071282719
ZINC000071282720
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