1-(2,3-dimethylphenyl)-3-methyl-4-(4-methylbenzoyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(2,3-dimethylphenyl)-3-methyl-4-(4-methylbenzoyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(2,3-dimethylphenyl)-3-methyl-4-(4-methylbenzoyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J013-1363 |
| Compound Name: | 1-(2,3-dimethylphenyl)-3-methyl-4-(4-methylbenzoyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 373.45 |
| Molecular Formula: | C23 H23 N3 O2 |
| Smiles: | Cc1ccc(cc1)C(C1CC(Nc2c1c(C)nn2c1cccc(C)c1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1376 |
| logD: | 4.1328 |
| logSw: | -4.2033 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.529 |
| InChI Key: | BZFGUHTZWSGBDE-SFHVURJKSA-N |