1-(2,4-difluorophenyl)-4-(3,4-dimethoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(2,4-difluorophenyl)-4-(3,4-dimethoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(2,4-difluorophenyl)-4-(3,4-dimethoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J013-1254 |
| Compound Name: | 1-(2,4-difluorophenyl)-4-(3,4-dimethoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 427.41 |
| Molecular Formula: | C22 H19 F2 N3 O4 |
| Smiles: | Cc1c2C(CC(Nc2n(c2ccc(cc2F)F)n1)=O)C(c1ccc(c(c1)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5003 |
| logD: | 2.4886 |
| logSw: | -3.0196 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.79 |
| InChI Key: | XBMDMIULKTZGAF-AWEZNQCLSA-N |