{5-[(3-chlorophenyl)methyl]-4-[4-(methanesulfonyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-2-yl}acetonitrile
Chemical Structure Depiction of
{5-[(3-chlorophenyl)methyl]-4-[4-(methanesulfonyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-2-yl}acetonitrile
{5-[(3-chlorophenyl)methyl]-4-[4-(methanesulfonyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-2-yl}acetonitrile
Compound characteristics
| Compound ID: | V027-8648 |
| Compound Name: | {5-[(3-chlorophenyl)methyl]-4-[4-(methanesulfonyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-2-yl}acetonitrile |
| Molecular Weight: | 473.9 |
| Molecular Formula: | C19 H19 Cl F3 N5 O2 S |
| Salt: | not_available |
| Smiles: | CS(N1CCN(CC1)c1c(Cc2cccc(c2)[Cl])c(C(F)(F)F)nc(CC#N)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6598 |
| logD: | 3.6598 |
| logSw: | -4.0099 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 72.459 |
| InChI Key: | RRQIVWANMPTDGX-UHFFFAOYSA-N |