ethyl 4-(2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-1-ethyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-1-ethyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamido)benzoate
ethyl 4-(2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-1-ethyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamido)benzoate
Compound characteristics
| Compound ID: | 8014-7887 |
| Compound Name: | ethyl 4-(2-{3-[(2H-1,3-benzodioxol-5-yl)methyl]-1-ethyl-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamido)benzoate |
| Molecular Weight: | 483.54 |
| Molecular Formula: | C24 H25 N3 O6 S |
| Smiles: | CCN1C(C(CC(Nc2ccc(cc2)C(=O)OCC)=O)N(Cc2ccc3c(c2)OCO3)C1=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1942 |
| logD: | 3.1939 |
| logSw: | -3.4184 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.874 |
| InChI Key: | VWHPFMCHQFZHDO-GOSISDBHSA-N |