2-(3,5-dimethylphenyl)-4-[(4-fluorophenyl)methyl]-3,5-dioxo-N-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
2-(3,5-dimethylphenyl)-4-[(4-fluorophenyl)methyl]-3,5-dioxo-N-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
2-(3,5-dimethylphenyl)-4-[(4-fluorophenyl)methyl]-3,5-dioxo-N-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V023-6662 |
| Compound Name: | 2-(3,5-dimethylphenyl)-4-[(4-fluorophenyl)methyl]-3,5-dioxo-N-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 459.48 |
| Molecular Formula: | C25 H22 F N5 O3 |
| Salt: | not_available |
| Smiles: | Cc1cc(C)cc(c1)N1C(N(Cc2ccc(cc2)F)C(C(C(NCc2ccccn2)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7856 |
| logD: | 3.7634 |
| logSw: | -3.8197 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.201 |
| InChI Key: | NGOJNPNEFOLTFD-UHFFFAOYSA-N |