ethyl 4-{3-(2-acetamidoethyl)-5-oxo-4-[2-oxo-2-(4-propoxyanilino)ethyl]-2-sulfanylideneimidazolidin-1-yl}benzoate
Chemical Structure Depiction of
ethyl 4-{3-(2-acetamidoethyl)-5-oxo-4-[2-oxo-2-(4-propoxyanilino)ethyl]-2-sulfanylideneimidazolidin-1-yl}benzoate
ethyl 4-{3-(2-acetamidoethyl)-5-oxo-4-[2-oxo-2-(4-propoxyanilino)ethyl]-2-sulfanylideneimidazolidin-1-yl}benzoate
Compound characteristics
| Compound ID: | C148-0455 |
| Compound Name: | ethyl 4-{3-(2-acetamidoethyl)-5-oxo-4-[2-oxo-2-(4-propoxyanilino)ethyl]-2-sulfanylideneimidazolidin-1-yl}benzoate |
| Molecular Weight: | 540.64 |
| Molecular Formula: | C27 H32 N4 O6 S |
| Smiles: | CCCOc1ccc(cc1)NC(CC1C(N(C(N1CCNC(C)=O)=S)c1ccc(cc1)C(=O)OCC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6725 |
| logD: | 2.6725 |
| logSw: | -2.9922 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.244 |
| InChI Key: | XSDGYVNRZRDKBV-HSZRJFAPSA-N |