4-(1-benzofuran-2-carbonyl)-1-(4-chlorophenyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
4-(1-benzofuran-2-carbonyl)-1-(4-chlorophenyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
4-(1-benzofuran-2-carbonyl)-1-(4-chlorophenyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J013-1700 |
| Compound Name: | 4-(1-benzofuran-2-carbonyl)-1-(4-chlorophenyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 405.84 |
| Molecular Formula: | C22 H16 Cl N3 O3 |
| Smiles: | Cc1c2C(CC(Nc2n(c2ccc(cc2)[Cl])n1)=O)C(c1cc2ccccc2o1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1541 |
| logD: | 4.1247 |
| logSw: | -4.4131 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.123 |
| InChI Key: | URRHWRGLPMTCDP-INIZCTEOSA-N |