Vitas-M small molecule compound
1-(1H-benzimidazol-2-yl)-4-(4-hydroxy-3,5-dimethoxyphenyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Catalog ID
STK692805
SMILES COc1cc(cc(c1O)OC)C1CC(=O)Nc2c1c(C)nn2c1nc2c([nH]1)cccc2
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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 C22H21N5O4 MW 419.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N5O4/c1-11-19-13(12-8-16(30-2)20(29)17(9-12)31-3)10-18(28)25-21(19)27(26-11)22-23-14-6-4-5-7-15(14)24-22/h4-9,13,29H,10H2,1-3H3,(H,23,24)(H,25,28)InChIKey
ACWBFENTBWWKBK-UHFFFAOYSA-NSynonyms
1(1Hbenzimidazol2yl)4(4hydroxy35dimethoxyphenyl)3methyl1457tetrahydro6Hpyrazolo(34b)pyridin6one
COc1cc(cc(c1O)OC)C1CC(=O)Nc2c1c(C)nn2c1nc2c((nH)1)cccc2
MFCD10038822
ZINC000015084852
ZINC000015084854
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