1-[4-(2-fluorophenyl)piperazin-1-yl]-2-({6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl}sulfanyl)ethan-1-one
Chemical Structure Depiction of
1-[4-(2-fluorophenyl)piperazin-1-yl]-2-({6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl}sulfanyl)ethan-1-one
1-[4-(2-fluorophenyl)piperazin-1-yl]-2-({6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl}sulfanyl)ethan-1-one
Compound characteristics
| Compound ID: | M181-0804 |
| Compound Name: | 1-[4-(2-fluorophenyl)piperazin-1-yl]-2-({6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl}sulfanyl)ethan-1-one |
| Molecular Weight: | 490.52 |
| Molecular Formula: | C24 H22 F4 N4 O S |
| Smiles: | Cc1cc(nc(c2ccc(cc2)C(F)(F)F)n1)SCC(N1CCN(CC1)c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6938 |
| logD: | 5.6893 |
| logSw: | -5.4899 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.786 |
| InChI Key: | BWHBANGXPZQPHZ-UHFFFAOYSA-N |