1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}ethan-1-one
1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | 6466-0918 |
| Compound Name: | 1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-2-{[4-(furan-2-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 496.94 |
| Molecular Formula: | C22 H20 Cl F3 N4 O2 S |
| Smiles: | Cc1ccc(cc1N1CCN(CC1)C(CSc1nc(cc(C(F)(F)F)n1)c1ccco1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.3962 |
| logD: | 5.3962 |
| logSw: | -5.8899 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.919 |
| InChI Key: | LIYLCWGNHPAKJO-UHFFFAOYSA-N |