ethyl 3-(2-{1-(4-ethoxyphenyl)-5-oxo-3-[(pyridin-2-yl)methyl]-2-sulfanylideneimidazolidin-4-yl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 3-(2-{1-(4-ethoxyphenyl)-5-oxo-3-[(pyridin-2-yl)methyl]-2-sulfanylideneimidazolidin-4-yl}acetamido)benzoate
ethyl 3-(2-{1-(4-ethoxyphenyl)-5-oxo-3-[(pyridin-2-yl)methyl]-2-sulfanylideneimidazolidin-4-yl}acetamido)benzoate
Compound characteristics
| Compound ID: | C148-0782 |
| Compound Name: | ethyl 3-(2-{1-(4-ethoxyphenyl)-5-oxo-3-[(pyridin-2-yl)methyl]-2-sulfanylideneimidazolidin-4-yl}acetamido)benzoate |
| Molecular Weight: | 532.62 |
| Molecular Formula: | C28 H28 N4 O5 S |
| Smiles: | CCOC(c1cccc(c1)NC(CC1C(N(C(N1Cc1ccccn1)=S)c1ccc(cc1)OCC)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7264 |
| logD: | 3.7264 |
| logSw: | -4.0152 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.817 |
| InChI Key: | ZWUHRXNKQPFNET-XMMPIXPASA-N |