N-[(4-fluorophenyl)methyl]-3-[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
N-[(4-fluorophenyl)methyl]-3-[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazole-5-carboxamide
N-[(4-fluorophenyl)methyl]-3-[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | F486-1061 |
| Compound Name: | N-[(4-fluorophenyl)methyl]-3-[4-methyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 436.4 |
| Molecular Formula: | C21 H17 F N6 O4 |
| Smiles: | Cc1ccc(cc1)N1C(N(C)C(C(c2nc(C(NCc3ccc(cc3)F)=O)on2)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7929 |
| logD: | 2.7919 |
| logSw: | -3.3252 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.373 |
| InChI Key: | WABUNHRLRILMLO-UHFFFAOYSA-N |