ethyl 4-{3-(benzenesulfonyl)-4-hydroxy-5-oxo-2-[4-(propan-2-yl)phenyl]-2,5-dihydro-1H-pyrrol-1-yl}benzoate
Chemical Structure Depiction of
ethyl 4-{3-(benzenesulfonyl)-4-hydroxy-5-oxo-2-[4-(propan-2-yl)phenyl]-2,5-dihydro-1H-pyrrol-1-yl}benzoate
ethyl 4-{3-(benzenesulfonyl)-4-hydroxy-5-oxo-2-[4-(propan-2-yl)phenyl]-2,5-dihydro-1H-pyrrol-1-yl}benzoate
Compound characteristics
| Compound ID: | F232-0415 |
| Compound Name: | ethyl 4-{3-(benzenesulfonyl)-4-hydroxy-5-oxo-2-[4-(propan-2-yl)phenyl]-2,5-dihydro-1H-pyrrol-1-yl}benzoate |
| Molecular Weight: | 505.59 |
| Molecular Formula: | C28 H27 N O6 S |
| Smiles: | CCOC(c1ccc(cc1)N1C(C(=C(C1=O)O)S(c1ccccc1)(=O)=O)c1ccc(cc1)C(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5983 |
| logD: | 5.5872 |
| logSw: | -5.5115 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.003 |
| InChI Key: | NXZDTHBOXWRPKE-XMMPIXPASA-N |