3,4,5-triethoxy-N-[3-(2-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]benzamide
Chemical Structure Depiction of
3,4,5-triethoxy-N-[3-(2-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]benzamide
3,4,5-triethoxy-N-[3-(2-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]benzamide
Compound characteristics
| Compound ID: | E157-4037 |
| Compound Name: | 3,4,5-triethoxy-N-[3-(2-methylphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]benzamide |
| Molecular Weight: | 467.55 |
| Molecular Formula: | C23 H25 N5 O4 S |
| Smiles: | CCOc1cc(cc(c1OCC)OCC)C(Nc1nn2c(c3ccccc3C)nnc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1257 |
| logD: | 4.1248 |
| logSw: | -4.2387 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.843 |
| InChI Key: | VBBXITHPCQEFCS-UHFFFAOYSA-N |