ethyl 4-(2-{3-[3-(4-ethylpiperazin-1-yl)propyl]-5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{3-[3-(4-ethylpiperazin-1-yl)propyl]-5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl}acetamido)benzoate
ethyl 4-(2-{3-[3-(4-ethylpiperazin-1-yl)propyl]-5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl}acetamido)benzoate
Compound characteristics
| Compound ID: | C089-0524 |
| Compound Name: | ethyl 4-(2-{3-[3-(4-ethylpiperazin-1-yl)propyl]-5-oxo-1-phenyl-2-sulfanylideneimidazolidin-4-yl}acetamido)benzoate |
| Molecular Weight: | 551.71 |
| Molecular Formula: | C29 H37 N5 O4 S |
| Smiles: | CCN1CCN(CCCN2C(CC(Nc3ccc(cc3)C(=O)OCC)=O)C(N(C2=S)c2ccccc2)=O)CC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6703 |
| logD: | 1.7221 |
| logSw: | -3.0327 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.648 |
| InChI Key: | KOVFUOIPMMXCNY-RUZDIDTESA-N |