methyl 4-[3-(benzenesulfonyl)-1-benzyl-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]benzoate
Chemical Structure Depiction of
methyl 4-[3-(benzenesulfonyl)-1-benzyl-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]benzoate
methyl 4-[3-(benzenesulfonyl)-1-benzyl-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]benzoate
Compound characteristics
| Compound ID: | F232-0637 |
| Compound Name: | methyl 4-[3-(benzenesulfonyl)-1-benzyl-4-hydroxy-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]benzoate |
| Molecular Weight: | 463.51 |
| Molecular Formula: | C25 H21 N O6 S |
| Smiles: | COC(c1ccc(cc1)C1C(=C(C(N1Cc1ccccc1)=O)O)S(c1ccccc1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7753 |
| logD: | 3.7434 |
| logSw: | -3.9966 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.034 |
| InChI Key: | GUQRADUWQQPUGO-OAQYLSRUSA-N |