2-{1-(3-chloro-4-methoxyphenyl)-5-oxo-3-[3-(4-phenylpiperazin-1-yl)propyl]-2-sulfanylideneimidazolidin-4-yl}-N-(4-ethoxyphenyl)acetamide
Chemical Structure Depiction of
2-{1-(3-chloro-4-methoxyphenyl)-5-oxo-3-[3-(4-phenylpiperazin-1-yl)propyl]-2-sulfanylideneimidazolidin-4-yl}-N-(4-ethoxyphenyl)acetamide
2-{1-(3-chloro-4-methoxyphenyl)-5-oxo-3-[3-(4-phenylpiperazin-1-yl)propyl]-2-sulfanylideneimidazolidin-4-yl}-N-(4-ethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C148-0614 |
| Compound Name: | 2-{1-(3-chloro-4-methoxyphenyl)-5-oxo-3-[3-(4-phenylpiperazin-1-yl)propyl]-2-sulfanylideneimidazolidin-4-yl}-N-(4-ethoxyphenyl)acetamide |
| Molecular Weight: | 636.21 |
| Molecular Formula: | C33 H38 Cl N5 O4 S |
| Smiles: | CCOc1ccc(cc1)NC(CC1C(N(C(N1CCCN1CCN(CC1)c1ccccc1)=S)c1ccc(c(c1)[Cl])OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4071 |
| logD: | 4.1804 |
| logSw: | -4.5315 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.372 |
| InChI Key: | OFRZSAGGHVLRCB-GDLZYMKVSA-N |