1-(2,4-difluorophenyl)-4-(4-ethylbenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(2,4-difluorophenyl)-4-(4-ethylbenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(2,4-difluorophenyl)-4-(4-ethylbenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J013-1287 |
| Compound Name: | 1-(2,4-difluorophenyl)-4-(4-ethylbenzoyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 395.41 |
| Molecular Formula: | C22 H19 F2 N3 O2 |
| Smiles: | CCc1ccc(cc1)C(C1CC(Nc2c1c(C)nn2c1ccc(cc1F)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7327 |
| logD: | 3.721 |
| logSw: | -4.0635 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.529 |
| InChI Key: | LOKQOVPAAUHRJN-INIZCTEOSA-N |