2-[5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]-N-{[4-(trifluoromethoxy)phenyl]methyl}piperidine-1-carboxamide
Chemical Structure Depiction of
2-[5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]-N-{[4-(trifluoromethoxy)phenyl]methyl}piperidine-1-carboxamide
2-[5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]-N-{[4-(trifluoromethoxy)phenyl]methyl}piperidine-1-carboxamide
Compound characteristics
| Compound ID: | M754-2041 |
| Compound Name: | 2-[5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]-N-{[4-(trifluoromethoxy)phenyl]methyl}piperidine-1-carboxamide |
| Molecular Weight: | 446.43 |
| Molecular Formula: | C21 H21 F3 N6 O2 |
| Smiles: | C1CCN(C(C1)c1nnc(c2cccnc2)[nH]1)C(NCc1ccc(cc1)OC(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0116 |
| logD: | 2.9071 |
| logSw: | -3.0996 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.691 |
| InChI Key: | QBHGCYRRJXMVNK-KRWDZBQOSA-N |