1-(3-ethylphenyl)-4-(4-hydroxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(3-ethylphenyl)-4-(4-hydroxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(3-ethylphenyl)-4-(4-hydroxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J013-1453 |
| Compound Name: | 1-(3-ethylphenyl)-4-(4-hydroxybenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 375.43 |
| Molecular Formula: | C22 H21 N3 O3 |
| Smiles: | CCc1cccc(c1)n1c2c(C(CC(N2)=O)C(c2ccc(cc2)O)=O)c(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9384 |
| logD: | 2.8458 |
| logSw: | -3.1316 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.447 |
| InChI Key: | XQRQMCBAVKLVJL-SFHVURJKSA-N |