7-(4-bromo-3-methylanilino)-6-(4-ethoxyphenyl)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Chemical Structure Depiction of
7-(4-bromo-3-methylanilino)-6-(4-ethoxyphenyl)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
7-(4-bromo-3-methylanilino)-6-(4-ethoxyphenyl)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one
Compound characteristics
Compound ID: | C612-0648 |
Compound Name: | 7-(4-bromo-3-methylanilino)-6-(4-ethoxyphenyl)-6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-one |
Molecular Weight: | 438.32 |
Molecular Formula: | C22 H20 Br N3 O2 |
Smiles: | CCOc1ccc(cc1)N1C(c2c(cccn2)C1=O)Nc1ccc(c(C)c1)[Br] |
Stereo: | RACEMIC MIXTURE |
logP: | 5.0039 |
logD: | 5.0039 |
logSw: | -4.5392 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 41.423 |
InChI Key: | AWFDVHNWHUHKFG-NRFANRHFSA-N |