4-[(4-fluorophenyl)methyl]-2-(3-methoxyphenyl)-3,5-dioxo-N-[(pyridin-3-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
4-[(4-fluorophenyl)methyl]-2-(3-methoxyphenyl)-3,5-dioxo-N-[(pyridin-3-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
4-[(4-fluorophenyl)methyl]-2-(3-methoxyphenyl)-3,5-dioxo-N-[(pyridin-3-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V022-0877 |
| Compound Name: | 4-[(4-fluorophenyl)methyl]-2-(3-methoxyphenyl)-3,5-dioxo-N-[(pyridin-3-yl)methyl]-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 461.45 |
| Molecular Formula: | C24 H20 F N5 O4 |
| Smiles: | COc1cccc(c1)N1C(N(Cc2ccc(cc2)F)C(C(C(NCc2cccnc2)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6203 |
| logD: | 2.6178 |
| logSw: | -2.5561 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.72 |
| InChI Key: | NUBGCQXHOUBYAN-UHFFFAOYSA-N |