N-(4-ethoxyphenyl)-2-{1-[3-(methylsulfanyl)phenyl]-5-oxo-3-[3-(4-phenylpiperazin-1-yl)propyl]-2-sulfanylideneimidazolidin-4-yl}acetamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-2-{1-[3-(methylsulfanyl)phenyl]-5-oxo-3-[3-(4-phenylpiperazin-1-yl)propyl]-2-sulfanylideneimidazolidin-4-yl}acetamide
N-(4-ethoxyphenyl)-2-{1-[3-(methylsulfanyl)phenyl]-5-oxo-3-[3-(4-phenylpiperazin-1-yl)propyl]-2-sulfanylideneimidazolidin-4-yl}acetamide
Compound characteristics
| Compound ID: | C148-0617 |
| Compound Name: | N-(4-ethoxyphenyl)-2-{1-[3-(methylsulfanyl)phenyl]-5-oxo-3-[3-(4-phenylpiperazin-1-yl)propyl]-2-sulfanylideneimidazolidin-4-yl}acetamide |
| Molecular Weight: | 617.83 |
| Molecular Formula: | C33 H39 N5 O3 S2 |
| Smiles: | CCOc1ccc(cc1)NC(CC1C(N(C(N1CCCN1CCN(CC1)c1ccccc1)=S)c1cccc(c1)SC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4601 |
| logD: | 4.2333 |
| logSw: | -4.1121 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.742 |
| InChI Key: | AFOAFQMXIOXLEO-SSEXGKCCSA-N |