2-[1-(3-chloro-4-methoxyphenyl)-3-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-[1-(3-chloro-4-methoxyphenyl)-3-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-fluorophenyl)acetamide
2-[1-(3-chloro-4-methoxyphenyl)-3-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | C089-0249 |
| Compound Name: | 2-[1-(3-chloro-4-methoxyphenyl)-3-{3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl}-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-fluorophenyl)acetamide |
| Molecular Weight: | 640.18 |
| Molecular Formula: | C32 H35 Cl F N5 O4 S |
| Smiles: | COc1ccc(cc1)N1CCN(CCCN2C(CC(Nc3ccc(cc3)F)=O)C(N(C2=S)c2ccc(c(c2)[Cl])OC)=O)CC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1712 |
| logD: | 3.944 |
| logSw: | -4.4197 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.792 |
| InChI Key: | FPVSPCDYAOFYDD-MUUNZHRXSA-N |