4-[(4-fluorophenyl)methyl]-2-(3-methylphenyl)-3,5-dioxo-N-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
4-[(4-fluorophenyl)methyl]-2-(3-methylphenyl)-3,5-dioxo-N-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
4-[(4-fluorophenyl)methyl]-2-(3-methylphenyl)-3,5-dioxo-N-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V023-4658 |
| Compound Name: | 4-[(4-fluorophenyl)methyl]-2-(3-methylphenyl)-3,5-dioxo-N-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 445.45 |
| Molecular Formula: | C24 H20 F N5 O3 |
| Smiles: | Cc1cccc(c1)N1C(N(Cc2ccc(cc2)F)C(C(C(NCc2ccccn2)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2727 |
| logD: | 3.2505 |
| logSw: | -3.4095 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.201 |
| InChI Key: | BMPCRPFLTCGTKC-UHFFFAOYSA-N |