3-{3-[4-ethyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-(3-fluorophenyl)propanamide
Chemical Structure Depiction of
3-{3-[4-ethyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-(3-fluorophenyl)propanamide
3-{3-[4-ethyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-(3-fluorophenyl)propanamide
Compound characteristics
| Compound ID: | F506-0739 |
| Compound Name: | 3-{3-[4-ethyl-2-(4-methylphenyl)-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-(3-fluorophenyl)propanamide |
| Molecular Weight: | 464.46 |
| Molecular Formula: | C23 H21 F N6 O4 |
| Smiles: | CCN1C(C(c2nc(CCC(Nc3cccc(c3)F)=O)on2)=NN(C1=O)c1ccc(C)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5811 |
| logD: | 3.5809 |
| logSw: | -3.6414 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.462 |
| InChI Key: | HLBGFUYRMXFHIP-UHFFFAOYSA-N |