1-(3,5-dimethylphenyl)-4-(4-fluoro-3-methoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(3,5-dimethylphenyl)-4-(4-fluoro-3-methoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(3,5-dimethylphenyl)-4-(4-fluoro-3-methoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J013-1701 |
| Compound Name: | 1-(3,5-dimethylphenyl)-4-(4-fluoro-3-methoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 407.44 |
| Molecular Formula: | C23 H22 F N3 O3 |
| Smiles: | Cc1cc(C)cc(c1)n1c2c(C(CC(N2)=O)C(c2ccc(c(c2)OC)F)=O)c(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.842 |
| logD: | 3.8303 |
| logSw: | -4.1257 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.46 |
| InChI Key: | AYONCWWKNXOXSV-QGZVFWFLSA-N |