3-{5-oxo-3-[3-(trifluoromethyl)phenyl]-2,5-dihydro-1,2,4-triazin-6-yl}-N-[2-(pyridin-2-yl)ethyl]propanamide
Chemical Structure Depiction of
3-{5-oxo-3-[3-(trifluoromethyl)phenyl]-2,5-dihydro-1,2,4-triazin-6-yl}-N-[2-(pyridin-2-yl)ethyl]propanamide
3-{5-oxo-3-[3-(trifluoromethyl)phenyl]-2,5-dihydro-1,2,4-triazin-6-yl}-N-[2-(pyridin-2-yl)ethyl]propanamide
Compound characteristics
| Compound ID: | V027-3100 |
| Compound Name: | 3-{5-oxo-3-[3-(trifluoromethyl)phenyl]-2,5-dihydro-1,2,4-triazin-6-yl}-N-[2-(pyridin-2-yl)ethyl]propanamide |
| Molecular Weight: | 417.39 |
| Molecular Formula: | C20 H18 F3 N5 O2 |
| Salt: | not_available |
| Smiles: | C(CC(NCCc1ccccn1)=O)C1C(N=C(c2cccc(c2)C(F)(F)F)NN=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5094 |
| logD: | 1.5094 |
| logSw: | -1.9883 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.164 |
| InChI Key: | RCMKZVWBAKJPPZ-UHFFFAOYSA-N |