1-(2,3-dimethylphenyl)-4-(4-hydroxy-3-methoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(2,3-dimethylphenyl)-4-(4-hydroxy-3-methoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(2,3-dimethylphenyl)-4-(4-hydroxy-3-methoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J013-1382 |
| Compound Name: | 1-(2,3-dimethylphenyl)-4-(4-hydroxy-3-methoxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 405.45 |
| Molecular Formula: | C23 H23 N3 O4 |
| Smiles: | Cc1cccc(c1C)n1c2c(C(CC(N2)=O)C(c2ccc(c(c2)OC)O)=O)c(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9956 |
| logD: | 2.821 |
| logSw: | -2.9684 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.707 |
| InChI Key: | PFTIEWAENQBMTJ-INIZCTEOSA-N |