ethyl 4-(4-{2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}-5-oxo-2-sulfanylidene-3-[(thiophen-2-yl)methyl]imidazolidin-1-yl)benzoate
Chemical Structure Depiction of
ethyl 4-(4-{2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}-5-oxo-2-sulfanylidene-3-[(thiophen-2-yl)methyl]imidazolidin-1-yl)benzoate
ethyl 4-(4-{2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}-5-oxo-2-sulfanylidene-3-[(thiophen-2-yl)methyl]imidazolidin-1-yl)benzoate
Compound characteristics
| Compound ID: | 8014-7575 |
| Compound Name: | ethyl 4-(4-{2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}-5-oxo-2-sulfanylidene-3-[(thiophen-2-yl)methyl]imidazolidin-1-yl)benzoate |
| Molecular Weight: | 565.67 |
| Molecular Formula: | C28 H27 N3 O6 S2 |
| Smiles: | CCOC(c1ccc(cc1)NC(CC1C(N(C(N1Cc1cccs1)=S)c1ccc(cc1)C(=O)OCC)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7209 |
| logD: | 4.7206 |
| logSw: | -4.3875 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.923 |
| InChI Key: | AKKFNVFNFFGEQI-HSZRJFAPSA-N |