2-{1-(3-chloro-4-methoxyphenyl)-3-[3-(4-methylpiperidin-1-yl)propyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-ethoxyphenyl)acetamide
Chemical Structure Depiction of
2-{1-(3-chloro-4-methoxyphenyl)-3-[3-(4-methylpiperidin-1-yl)propyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-ethoxyphenyl)acetamide
2-{1-(3-chloro-4-methoxyphenyl)-3-[3-(4-methylpiperidin-1-yl)propyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-ethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C089-0049 |
| Compound Name: | 2-{1-(3-chloro-4-methoxyphenyl)-3-[3-(4-methylpiperidin-1-yl)propyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl}-N-(4-ethoxyphenyl)acetamide |
| Molecular Weight: | 573.15 |
| Molecular Formula: | C29 H37 Cl N4 O4 S |
| Smiles: | CCOc1ccc(cc1)NC(CC1C(N(C(N1CCCN1CCC(C)CC1)=S)c1ccc(c(c1)[Cl])OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1741 |
| logD: | 2.2715 |
| logSw: | -4.443 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.112 |
| InChI Key: | JFPADSSFISCGAX-RUZDIDTESA-N |