methyl 4-{3-(benzenesulfonyl)-4-hydroxy-1-[(4-methylphenyl)methyl]-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}benzoate
Chemical Structure Depiction of
methyl 4-{3-(benzenesulfonyl)-4-hydroxy-1-[(4-methylphenyl)methyl]-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}benzoate
methyl 4-{3-(benzenesulfonyl)-4-hydroxy-1-[(4-methylphenyl)methyl]-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}benzoate
Compound characteristics
| Compound ID: | F232-0684 |
| Compound Name: | methyl 4-{3-(benzenesulfonyl)-4-hydroxy-1-[(4-methylphenyl)methyl]-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}benzoate |
| Molecular Weight: | 477.54 |
| Molecular Formula: | C26 H23 N O6 S |
| Smiles: | Cc1ccc(CN2C(C(=C(C2=O)O)S(c2ccccc2)(=O)=O)c2ccc(cc2)C(=O)OC)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1987 |
| logD: | 4.1668 |
| logSw: | -4.1473 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.034 |
| InChI Key: | JEOAUFDGEMHUKX-JOCHJYFZSA-N |