N-[3-(methylsulfanyl)propyl]-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline-4-carboxamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)propyl]-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline-4-carboxamide
N-[3-(methylsulfanyl)propyl]-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline-4-carboxamide
Compound characteristics
| Compound ID: | V009-5868 |
| Compound Name: | N-[3-(methylsulfanyl)propyl]-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline-4-carboxamide |
| Molecular Weight: | 488.57 |
| Molecular Formula: | C25 H27 F3 N4 O S |
| Salt: | not_available |
| Smiles: | CSCCCNC(c1cc(nc2ccccc12)N1CCN(CC1)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7413 |
| logD: | 5.7413 |
| logSw: | -5.8023 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.272 |
| InChI Key: | ZNDMQZPNCMPBMW-UHFFFAOYSA-N |