4-[(3-fluorophenyl)methyl]-2-(4-methoxyphenyl)-3,5-dioxo-N-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
4-[(3-fluorophenyl)methyl]-2-(4-methoxyphenyl)-3,5-dioxo-N-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
4-[(3-fluorophenyl)methyl]-2-(4-methoxyphenyl)-3,5-dioxo-N-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V022-1401 |
| Compound Name: | 4-[(3-fluorophenyl)methyl]-2-(4-methoxyphenyl)-3,5-dioxo-N-[(pyridin-2-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 461.45 |
| Molecular Formula: | C24 H20 F N5 O4 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)N1C(N(Cc2cccc(c2)F)C(C(C(NCc2ccccn2)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.845 |
| logD: | 2.8228 |
| logSw: | -3.4862 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.745 |
| InChI Key: | TXAAPODTRZPTKL-UHFFFAOYSA-N |