2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,5-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,5-dimethoxyphenyl)acetamide
2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,5-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | K784-1987 |
| Compound Name: | 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,5-dimethoxyphenyl)acetamide |
| Molecular Weight: | 309.34 |
| Molecular Formula: | C12 H15 N5 O3 S |
| Smiles: | COc1ccc(c(c1)NC(CSc1nc(N)[nH]n1)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 0.8362 |
| logD: | 0.8346 |
| logSw: | -2.3507 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 90.837 |
| InChI Key: | XACQCJGDGYMHKB-UHFFFAOYSA-N |