N-(4-ethoxyphenyl)-2-{3-[2-(4-methylpiperazin-1-yl)ethyl]-1-[3-(methylsulfanyl)phenyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-2-{3-[2-(4-methylpiperazin-1-yl)ethyl]-1-[3-(methylsulfanyl)phenyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamide
N-(4-ethoxyphenyl)-2-{3-[2-(4-methylpiperazin-1-yl)ethyl]-1-[3-(methylsulfanyl)phenyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamide
Compound characteristics
| Compound ID: | C148-0465 |
| Compound Name: | N-(4-ethoxyphenyl)-2-{3-[2-(4-methylpiperazin-1-yl)ethyl]-1-[3-(methylsulfanyl)phenyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}acetamide |
| Molecular Weight: | 541.73 |
| Molecular Formula: | C27 H35 N5 O3 S2 |
| Smiles: | CCOc1ccc(cc1)NC(CC1C(N(C(N1CCN1CCN(C)CC1)=S)c1cccc(c1)SC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5068 |
| logD: | 1.2624 |
| logSw: | -2.9964 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.958 |
| InChI Key: | HRVJBTWEDLGAEO-XMMPIXPASA-N |