3-{3-[2-(4-chlorophenyl)-4-ethyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-(2-ethylphenyl)-N-methylpropanamide
Chemical Structure Depiction of
3-{3-[2-(4-chlorophenyl)-4-ethyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-(2-ethylphenyl)-N-methylpropanamide
3-{3-[2-(4-chlorophenyl)-4-ethyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-(2-ethylphenyl)-N-methylpropanamide
Compound characteristics
| Compound ID: | F506-1039 |
| Compound Name: | 3-{3-[2-(4-chlorophenyl)-4-ethyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-(2-ethylphenyl)-N-methylpropanamide |
| Molecular Weight: | 508.96 |
| Molecular Formula: | C25 H25 Cl N6 O4 |
| Smiles: | CCc1ccccc1N(C)C(CCc1nc(C2C(N(CC)C(N(c3ccc(cc3)[Cl])N=2)=O)=O)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3277 |
| logD: | 4.3277 |
| logSw: | -4.5286 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 88.125 |
| InChI Key: | AKIHWIBMOVMZCN-UHFFFAOYSA-N |