2-(3-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-1-[3-(methylsulfanyl)phenyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl)-N-(4-methoxyphenyl)acetamide
Chemical Structure Depiction of
2-(3-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-1-[3-(methylsulfanyl)phenyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl)-N-(4-methoxyphenyl)acetamide
2-(3-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-1-[3-(methylsulfanyl)phenyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl)-N-(4-methoxyphenyl)acetamide
Compound characteristics
| Compound ID: | C089-0017 |
| Compound Name: | 2-(3-{3-[4-(4-fluorophenyl)piperazin-1-yl]propyl}-1-[3-(methylsulfanyl)phenyl]-5-oxo-2-sulfanylideneimidazolidin-4-yl)-N-(4-methoxyphenyl)acetamide |
| Molecular Weight: | 621.8 |
| Molecular Formula: | C32 H36 F N5 O3 S2 |
| Smiles: | COc1ccc(cc1)NC(CC1C(N(C(N1CCCN1CCN(CC1)c1ccc(cc1)F)=S)c1cccc(c1)SC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2241 |
| logD: | 3.9974 |
| logSw: | -4.2224 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.162 |
| InChI Key: | AZIVGKYPGOXYBR-GDLZYMKVSA-N |