ethyl 4-{3-(2-acetamidoethyl)-4-[2-(4-ethoxyanilino)-2-oxoethyl]-5-oxo-2-sulfanylideneimidazolidin-1-yl}benzoate
Chemical Structure Depiction of
ethyl 4-{3-(2-acetamidoethyl)-4-[2-(4-ethoxyanilino)-2-oxoethyl]-5-oxo-2-sulfanylideneimidazolidin-1-yl}benzoate
ethyl 4-{3-(2-acetamidoethyl)-4-[2-(4-ethoxyanilino)-2-oxoethyl]-5-oxo-2-sulfanylideneimidazolidin-1-yl}benzoate
Compound characteristics
| Compound ID: | C148-0047 |
| Compound Name: | ethyl 4-{3-(2-acetamidoethyl)-4-[2-(4-ethoxyanilino)-2-oxoethyl]-5-oxo-2-sulfanylideneimidazolidin-1-yl}benzoate |
| Molecular Weight: | 526.61 |
| Molecular Formula: | C26 H30 N4 O6 S |
| Smiles: | CCOC(c1ccc(cc1)N1C(C(CC(Nc2ccc(cc2)OCC)=O)N(CCNC(C)=O)C1=S)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0821 |
| logD: | 2.0821 |
| logSw: | -2.7496 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.95 |
| InChI Key: | KIAXSYCDVWHHSA-JOCHJYFZSA-N |