methyl 4-[4-hydroxy-3-(4-methylbenzene-1-sulfonyl)-1-(4-methylphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]benzoate
Chemical Structure Depiction of
methyl 4-[4-hydroxy-3-(4-methylbenzene-1-sulfonyl)-1-(4-methylphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]benzoate
methyl 4-[4-hydroxy-3-(4-methylbenzene-1-sulfonyl)-1-(4-methylphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]benzoate
Compound characteristics
| Compound ID: | F232-0057 |
| Compound Name: | methyl 4-[4-hydroxy-3-(4-methylbenzene-1-sulfonyl)-1-(4-methylphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]benzoate |
| Molecular Weight: | 477.54 |
| Molecular Formula: | C26 H23 N O6 S |
| Smiles: | Cc1ccc(cc1)N1C(C(=C(C1=O)O)S(c1ccc(C)cc1)(=O)=O)c1ccc(cc1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7813 |
| logD: | 4.7701 |
| logSw: | -4.5023 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.423 |
| InChI Key: | VYQXBCCRCFJTRI-JOCHJYFZSA-N |