N-benzyl-4-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Chemical Structure Depiction of
N-benzyl-4-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
N-benzyl-4-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide
Compound characteristics
| Compound ID: | V023-0980 |
| Compound Name: | N-benzyl-4-[(4-fluorophenyl)methyl]-2-(4-methoxyphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazine-6-carboxamide |
| Molecular Weight: | 460.46 |
| Molecular Formula: | C25 H21 F N4 O4 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)N1C(N(Cc2ccc(cc2)F)C(C(C(NCc2ccccc2)=O)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6617 |
| logD: | 3.6475 |
| logSw: | -3.9732 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.202 |
| InChI Key: | OSADYEKJSSLNTP-UHFFFAOYSA-N |