7-(3-chloro-4-fluoroanilino)-6-[(4-fluorophenyl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Chemical Structure Depiction of
7-(3-chloro-4-fluoroanilino)-6-[(4-fluorophenyl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
7-(3-chloro-4-fluoroanilino)-6-[(4-fluorophenyl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Compound characteristics
| Compound ID: | C612-0673 |
| Compound Name: | 7-(3-chloro-4-fluoroanilino)-6-[(4-fluorophenyl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one |
| Molecular Weight: | 385.8 |
| Molecular Formula: | C20 H14 Cl F2 N3 O |
| Smiles: | C(c1ccc(cc1)F)N1C(c2c(cccn2)C1=O)Nc1ccc(c(c1)[Cl])F |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2619 |
| logD: | 4.2619 |
| logSw: | -4.5355 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.911 |
| InChI Key: | XNINVPFWGQFKRD-IBGZPJMESA-N |