2-{1-(3-chloro-4-methoxyphenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-ethoxyphenyl)acetamide
Chemical Structure Depiction of
2-{1-(3-chloro-4-methoxyphenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-ethoxyphenyl)acetamide
2-{1-(3-chloro-4-methoxyphenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-ethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C148-0250 |
| Compound Name: | 2-{1-(3-chloro-4-methoxyphenyl)-3-[2-(4-methylpiperazin-1-yl)ethyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-ethoxyphenyl)acetamide |
| Molecular Weight: | 560.12 |
| Molecular Formula: | C27 H34 Cl N5 O4 S |
| Smiles: | CCOc1ccc(cc1)NC(CC1C(N(C(N1CCN1CCN(C)CC1)=S)c1ccc(c(c1)[Cl])OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4538 |
| logD: | 1.2095 |
| logSw: | -3.4358 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.589 |
| InChI Key: | ZTNXRESSYXTSOL-HSZRJFAPSA-N |