4-(2H-1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)-1-phenyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
4-(2H-1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)-1-phenyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
4-(2H-1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)-1-phenyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | 7999-0650 |
| Compound Name: | 4-(2H-1,3-benzodioxol-5-yl)-3-(4-chlorophenyl)-1-phenyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 443.89 |
| Molecular Formula: | C25 H18 Cl N3 O3 |
| Smiles: | C1C(c2ccc3c(c2)OCO3)c2c(c3ccc(cc3)[Cl])nn(c3ccccc3)c2NC1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0669 |
| logD: | 5.0669 |
| logSw: | -5.6563 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.129 |
| InChI Key: | ITXAUOBLZSSECD-LJQANCHMSA-N |