N-ethyl-3-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-2-yl}sulfanyl)methyl]-N-methylbenzamide
Chemical Structure Depiction of
N-ethyl-3-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-2-yl}sulfanyl)methyl]-N-methylbenzamide
N-ethyl-3-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-2-yl}sulfanyl)methyl]-N-methylbenzamide
Compound characteristics
| Compound ID: | V027-3162 |
| Compound Name: | N-ethyl-3-[({4-[4-(4-methoxyphenyl)piperazin-1-yl]-6-(trifluoromethyl)pyrimidin-2-yl}sulfanyl)methyl]-N-methylbenzamide |
| Molecular Weight: | 545.63 |
| Molecular Formula: | C27 H30 F3 N5 O2 S |
| Salt: | not_available |
| Smiles: | CCN(C)C(c1cccc(CSc2nc(cc(n2)N2CCN(CC2)c2ccc(cc2)OC)C(F)(F)F)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5694 |
| logD: | 5.5693 |
| logSw: | -5.4413 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.127 |
| InChI Key: | GFTLYKPVLYNRLY-UHFFFAOYSA-N |