2-[3-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-1-(3,4-dichlorophenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-fluorophenyl)acetamide
Chemical Structure Depiction of
2-[3-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-1-(3,4-dichlorophenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-fluorophenyl)acetamide
2-[3-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-1-(3,4-dichlorophenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-fluorophenyl)acetamide
Compound characteristics
| Compound ID: | C089-0526 |
| Compound Name: | 2-[3-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-1-(3,4-dichlorophenyl)-5-oxo-2-sulfanylideneimidazolidin-4-yl]-N-(4-fluorophenyl)acetamide |
| Molecular Weight: | 649.01 |
| Molecular Formula: | C30 H29 Cl3 F N5 O2 S |
| Smiles: | C(CN1CCN(CC1)c1cccc(c1)[Cl])CN1C(CC(Nc2ccc(cc2)F)=O)C(N(C1=S)c1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6145 |
| logD: | 5.3873 |
| logSw: | -6.0015 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.618 |
| InChI Key: | RSASTBQSEVOFEW-HHHXNRCGSA-N |