4-(2H-1,3-benzodioxol-5-yl)-1-(4-chlorophenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
4-(2H-1,3-benzodioxol-5-yl)-1-(4-chlorophenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
4-(2H-1,3-benzodioxol-5-yl)-1-(4-chlorophenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J012-1983 |
| Compound Name: | 4-(2H-1,3-benzodioxol-5-yl)-1-(4-chlorophenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 367.79 |
| Molecular Formula: | C19 H14 Cl N3 O3 |
| Smiles: | C1C(c2ccc3c(c2)OCO3)c2cnn(c3ccc(cc3)[Cl])c2NC1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8622 |
| logD: | 3.8622 |
| logSw: | -4.6865 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.854 |
| InChI Key: | VHUASVHLMNNSKV-AWEZNQCLSA-N |