4-[(4-fluorophenyl)methyl]-3,5-dioxo-N-[2-(pyridin-2-yl)ethyl]-2-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
4-[(4-fluorophenyl)methyl]-3,5-dioxo-N-[2-(pyridin-2-yl)ethyl]-2-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
4-[(4-fluorophenyl)methyl]-3,5-dioxo-N-[2-(pyridin-2-yl)ethyl]-2-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V021-4871 |
| Compound Name: | 4-[(4-fluorophenyl)methyl]-3,5-dioxo-N-[2-(pyridin-2-yl)ethyl]-2-[3-(trifluoromethyl)phenyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 513.45 |
| Molecular Formula: | C25 H19 F4 N5 O3 |
| Salt: | not_available |
| Smiles: | C(CNC(C1C(N(Cc2ccc(cc2)F)C(N(c2cccc(c2)C(F)(F)F)N=1)=O)=O)=O)c1ccccn1 |
| Stereo: | ACHIRAL |
| logP: | 3.5663 |
| logD: | 3.5655 |
| logSw: | -3.8212 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.043 |
| InChI Key: | DOLHIEMKTZUEBM-UHFFFAOYSA-N |