3-[2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-N-[(furan-2-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
3-[2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-N-[(furan-2-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
3-[2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-N-[(furan-2-yl)methyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
| Compound ID: | F486-0668 |
| Compound Name: | 3-[2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-N-[(furan-2-yl)methyl]-1,2,4-oxadiazole-5-carboxamide |
| Molecular Weight: | 412.33 |
| Molecular Formula: | C18 H13 F N6 O5 |
| Smiles: | CN1C(C(c2nc(C(NCc3ccco3)=O)on2)=NN(C1=O)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1201 |
| logD: | 2.1196 |
| logSw: | -2.6972 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 106.122 |
| InChI Key: | BOULEMMWNBOFIR-UHFFFAOYSA-N |