7-(4-bromo-3-methylanilino)-6-(4-methylphenyl)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Chemical Structure Depiction of
7-(4-bromo-3-methylanilino)-6-(4-methylphenyl)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
7-(4-bromo-3-methylanilino)-6-(4-methylphenyl)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Compound characteristics
| Compound ID: | C999-1181 |
| Compound Name: | 7-(4-bromo-3-methylanilino)-6-(4-methylphenyl)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one |
| Molecular Weight: | 408.3 |
| Molecular Formula: | C21 H18 Br N3 O |
| Smiles: | Cc1ccc(cc1)N1C(c2c(cccn2)C1=O)Nc1ccc(c(C)c1)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0583 |
| logD: | 5.0583 |
| logSw: | -4.6079 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.299 |
| InChI Key: | LACINVFFWSDDPM-FQEVSTJZSA-N |