1-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(4-fluorophenyl)-3-hydroxy-4-(4-methylbenzene-1-sulfonyl)-1,5-dihydro-2H-pyrrol-2-one
Chemical Structure Depiction of
1-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(4-fluorophenyl)-3-hydroxy-4-(4-methylbenzene-1-sulfonyl)-1,5-dihydro-2H-pyrrol-2-one
1-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(4-fluorophenyl)-3-hydroxy-4-(4-methylbenzene-1-sulfonyl)-1,5-dihydro-2H-pyrrol-2-one
Compound characteristics
| Compound ID: | F232-1270 |
| Compound Name: | 1-[(2H-1,3-benzodioxol-5-yl)methyl]-5-(4-fluorophenyl)-3-hydroxy-4-(4-methylbenzene-1-sulfonyl)-1,5-dihydro-2H-pyrrol-2-one |
| Molecular Weight: | 481.5 |
| Molecular Formula: | C25 H20 F N O6 S |
| Smiles: | Cc1ccc(cc1)S(C1C(c2ccc(cc2)F)N(Cc2ccc3c(c2)OCO3)C(C=1O)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1932 |
| logD: | 4.1614 |
| logSw: | -4.1876 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.976 |
| InChI Key: | DSPILGGGXBQOIG-JOCHJYFZSA-N |