7-(4-bromo-2-fluoroanilino)-6-(4-ethoxyphenyl)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Chemical Structure Depiction of
7-(4-bromo-2-fluoroanilino)-6-(4-ethoxyphenyl)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
7-(4-bromo-2-fluoroanilino)-6-(4-ethoxyphenyl)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Compound characteristics
| Compound ID: | C612-0527 |
| Compound Name: | 7-(4-bromo-2-fluoroanilino)-6-(4-ethoxyphenyl)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one |
| Molecular Weight: | 442.29 |
| Molecular Formula: | C21 H17 Br F N3 O2 |
| Smiles: | CCOc1ccc(cc1)N1C(c2c(cccn2)C1=O)Nc1ccc(cc1F)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8701 |
| logD: | 4.8701 |
| logSw: | -4.48 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.725 |
| InChI Key: | JOTJUWFZNYMXGC-FQEVSTJZSA-N |