{5-[(3-chlorophenyl)methyl]-4-[4-(4-fluorobenzoyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-2-yl}acetonitrile
Chemical Structure Depiction of
{5-[(3-chlorophenyl)methyl]-4-[4-(4-fluorobenzoyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-2-yl}acetonitrile
{5-[(3-chlorophenyl)methyl]-4-[4-(4-fluorobenzoyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-2-yl}acetonitrile
Compound characteristics
| Compound ID: | V004-1791 |
| Compound Name: | {5-[(3-chlorophenyl)methyl]-4-[4-(4-fluorobenzoyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-2-yl}acetonitrile |
| Molecular Weight: | 517.91 |
| Molecular Formula: | C25 H20 Cl F4 N5 O |
| Salt: | not_available |
| Smiles: | C(C#N)c1nc(c(Cc2cccc(c2)[Cl])c(n1)N1CCN(CC1)C(c1ccc(cc1)F)=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 5.1023 |
| logD: | 5.1023 |
| logSw: | -5.614 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 57.632 |
| InChI Key: | PMYOESKWTZVMSE-UHFFFAOYSA-N |