2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(6-methylpyridin-2-yl)acetamide
Chemical Structure Depiction of
2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(6-methylpyridin-2-yl)acetamide
2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(6-methylpyridin-2-yl)acetamide
Compound characteristics
| Compound ID: | D419-0588 |
| Compound Name: | 2-{[5-(3,4-dimethoxyphenyl)-4-phenyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(6-methylpyridin-2-yl)acetamide |
| Molecular Weight: | 461.54 |
| Molecular Formula: | C24 H23 N5 O3 S |
| Smiles: | Cc1cccc(NC(CSc2nnc(c3ccc(c(c3)OC)OC)n2c2ccccc2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.9796 |
| logD: | 3.9795 |
| logSw: | -4.0885 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.112 |
| InChI Key: | NNGWSFMRIZPTEB-UHFFFAOYSA-N |