3-{3-[2-(4-chlorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-(3,4-dimethylphenyl)-N-methylpropanamide
Chemical Structure Depiction of
3-{3-[2-(4-chlorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-(3,4-dimethylphenyl)-N-methylpropanamide
3-{3-[2-(4-chlorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-(3,4-dimethylphenyl)-N-methylpropanamide
Compound characteristics
| Compound ID: | F506-0928 |
| Compound Name: | 3-{3-[2-(4-chlorophenyl)-4-methyl-3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl]-1,2,4-oxadiazol-5-yl}-N-(3,4-dimethylphenyl)-N-methylpropanamide |
| Molecular Weight: | 494.94 |
| Molecular Formula: | C24 H23 Cl N6 O4 |
| Smiles: | Cc1ccc(cc1C)N(C)C(CCc1nc(C2C(N(C)C(N(c3ccc(cc3)[Cl])N=2)=O)=O)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3163 |
| logD: | 4.3163 |
| logSw: | -4.5328 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 88.467 |
| InChI Key: | VJXSSRQQPCQSRM-UHFFFAOYSA-N |