1-(3-ethylphenyl)-3-methyl-4-[4-(propan-2-yl)benzoyl]-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(3-ethylphenyl)-3-methyl-4-[4-(propan-2-yl)benzoyl]-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(3-ethylphenyl)-3-methyl-4-[4-(propan-2-yl)benzoyl]-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J013-1452 |
| Compound Name: | 1-(3-ethylphenyl)-3-methyl-4-[4-(propan-2-yl)benzoyl]-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 401.51 |
| Molecular Formula: | C25 H27 N3 O2 |
| Smiles: | CCc1cccc(c1)n1c2c(C(CC(N2)=O)C(c2ccc(cc2)C(C)C)=O)c(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8963 |
| logD: | 4.8915 |
| logSw: | -4.5441 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.83 |
| InChI Key: | HIFNSLUSJJQACF-NRFANRHFSA-N |