7-(5-chloro-2-methoxyanilino)-6-[(4-methoxyphenyl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Chemical Structure Depiction of
7-(5-chloro-2-methoxyanilino)-6-[(4-methoxyphenyl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
7-(5-chloro-2-methoxyanilino)-6-[(4-methoxyphenyl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Compound characteristics
| Compound ID: | C612-0610 |
| Compound Name: | 7-(5-chloro-2-methoxyanilino)-6-[(4-methoxyphenyl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one |
| Molecular Weight: | 409.87 |
| Molecular Formula: | C22 H20 Cl N3 O3 |
| Smiles: | COc1ccc(CN2C(c3c(cccn3)C2=O)Nc2cc(ccc2OC)[Cl])cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0789 |
| logD: | 4.0789 |
| logSw: | -4.5597 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.387 |
| InChI Key: | CQWHSRNYGGHZSM-NRFANRHFSA-N |