2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-1-benzyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-1-benzyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-fluorophenyl)acetamide
2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-1-benzyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | 8014-7885 |
| Compound Name: | 2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-1-benzyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-fluorophenyl)acetamide |
| Molecular Weight: | 491.54 |
| Molecular Formula: | C26 H22 F N3 O4 S |
| Smiles: | C(C1C(N(Cc2ccccc2)C(N1Cc1ccc2c(c1)OCO2)=S)=O)C(Nc1ccc(cc1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.924 |
| logD: | 3.9235 |
| logSw: | -4.1928 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.124 |
| InChI Key: | QTXZUJYSMOZBAM-OAQYLSRUSA-N |