5-(4-bromophenyl)-3-hydroxy-4-{3-methyl-4-[(prop-2-en-1-yl)oxy]benzoyl}-1-[(pyridin-3-yl)methyl]-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
5-(4-bromophenyl)-3-hydroxy-4-{3-methyl-4-[(prop-2-en-1-yl)oxy]benzoyl}-1-[(pyridin-3-yl)methyl]-1,5-dihydro-2H-pyrrol-2-one
5-(4-bromophenyl)-3-hydroxy-4-{3-methyl-4-[(prop-2-en-1-yl)oxy]benzoyl}-1-[(pyridin-3-yl)methyl]-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | 4424-0478 |
| Compound Name: | 5-(4-bromophenyl)-3-hydroxy-4-{3-methyl-4-[(prop-2-en-1-yl)oxy]benzoyl}-1-[(pyridin-3-yl)methyl]-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 519.39 |
| Molecular Formula: | C27 H23 Br N2 O4 |
| Smiles: | Cc1cc(ccc1OCC=C)C(C1C(c2ccc(cc2)[Br])N(Cc2cccnc2)C(C=1O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9329 |
| logD: | 4.9294 |
| logSw: | -4.3684 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.849 |
| InChI Key: | JWDOKLVGNAXZCM-XMMPIXPASA-N |