7-(3,4-dichloroanilino)-6-[(4-methoxyphenyl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Chemical Structure Depiction of
7-(3,4-dichloroanilino)-6-[(4-methoxyphenyl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
7-(3,4-dichloroanilino)-6-[(4-methoxyphenyl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Compound characteristics
| Compound ID: | G804-1494 |
| Compound Name: | 7-(3,4-dichloroanilino)-6-[(4-methoxyphenyl)methyl]-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one |
| Molecular Weight: | 414.29 |
| Molecular Formula: | C21 H17 Cl2 N3 O2 |
| Smiles: | COc1ccc(CN2C(c3c(cccn3)C2=O)Nc2ccc(c(c2)[Cl])[Cl])cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9594 |
| logD: | 4.9594 |
| logSw: | -5.0388 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.455 |
| InChI Key: | XQYSXEFCJTXLML-FQEVSTJZSA-N |