4-(benzenesulfonyl)-1-[(2H-1,3-benzodioxol-5-yl)methyl]-3-hydroxy-5-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
4-(benzenesulfonyl)-1-[(2H-1,3-benzodioxol-5-yl)methyl]-3-hydroxy-5-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
4-(benzenesulfonyl)-1-[(2H-1,3-benzodioxol-5-yl)methyl]-3-hydroxy-5-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | F232-0769 |
| Compound Name: | 4-(benzenesulfonyl)-1-[(2H-1,3-benzodioxol-5-yl)methyl]-3-hydroxy-5-(4-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 479.51 |
| Molecular Formula: | C25 H21 N O7 S |
| Smiles: | COc1ccc(cc1)C1C(=C(C(N1Cc1ccc2c(c1)OCO2)=O)O)S(c1ccccc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5381 |
| logD: | 3.5062 |
| logSw: | -3.7898 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.52 |
| InChI Key: | STXDJCQQFAZONQ-JOCHJYFZSA-N |