2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-methoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-methoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-fluorophenyl)acetamide
2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-methoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | 8014-7883 |
| Compound Name: | 2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-methoxyphenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-fluorophenyl)acetamide |
| Molecular Weight: | 507.54 |
| Molecular Formula: | C26 H22 F N3 O5 S |
| Smiles: | COc1ccc(cc1)N1C(C(CC(Nc2ccc(cc2)F)=O)N(Cc2ccc3c(c2)OCO3)C1=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4307 |
| logD: | 3.4302 |
| logSw: | -3.8932 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.056 |
| InChI Key: | BYCOPENPYVMYLG-OAQYLSRUSA-N |