N-[4-(methylsulfanyl)phenyl]-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxamide
Chemical Structure Depiction of
N-[4-(methylsulfanyl)phenyl]-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxamide
N-[4-(methylsulfanyl)phenyl]-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | D012-0190 |
| Compound Name: | N-[4-(methylsulfanyl)phenyl]-4-[5-(trifluoromethyl)pyridin-2-yl]piperazine-1-carboxamide |
| Molecular Weight: | 396.43 |
| Molecular Formula: | C18 H19 F3 N4 O S |
| Smiles: | CSc1ccc(cc1)NC(N1CCN(CC1)c1ccc(cn1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3621 |
| logD: | 4.3621 |
| logSw: | -4.0443 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.569 |
| InChI Key: | ADTZYTVAVOQZEK-UHFFFAOYSA-N |