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-(5-ethyl-1,3,4-thiadiazol-2-yl)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-(5-ethyl-1,3,4-thiadiazol-2-yl)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-(5-ethyl-1,3,4-thiadiazol-2-yl)propanamide
Compound characteristics
| Compound ID: | F506-0711 |
| 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-(5-ethyl-1,3,4-thiadiazol-2-yl)propanamide |
| Molecular Weight: | 482.52 |
| Molecular Formula: | C21 H22 N8 O4 S |
| Smiles: | CCc1nnc(NC(CCc2nc(C3C(N(CC)C(N(c4ccc(C)cc4)N=3)=O)=O)no2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.0191 |
| logD: | 2.9323 |
| logSw: | -3.3186 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 120.502 |
| InChI Key: | RPVWDCIATHLOMY-UHFFFAOYSA-N |