3-{3-[2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-(2-phenylethyl)propanamide
Chemical Structure Depiction of
3-{3-[2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-(2-phenylethyl)propanamide
3-{3-[2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-(2-phenylethyl)propanamide
Compound characteristics
| Compound ID: | F506-0594 |
| Compound Name: | 3-{3-[2-(4-fluorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-(2-phenylethyl)propanamide |
| Molecular Weight: | 464.46 |
| Molecular Formula: | C23 H21 F N6 O4 |
| Smiles: | CN1C(C(c2nc(CCC(NCCc3ccccc3)=O)on2)=NN(C1=O)c1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2899 |
| logD: | 2.2899 |
| logSw: | -2.7612 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.667 |
| InChI Key: | XZSHEXLPYGIULM-UHFFFAOYSA-N |