2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(pyridin-2-yl)acetamide
Chemical Structure Depiction of
2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(pyridin-2-yl)acetamide
2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(pyridin-2-yl)acetamide
Compound characteristics
| Compound ID: | D419-0059 |
| Compound Name: | 2-[(4,5-diphenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-(pyridin-2-yl)acetamide |
| Molecular Weight: | 387.46 |
| Molecular Formula: | C21 H17 N5 O S |
| Smiles: | C(C(Nc1ccccn1)=O)Sc1nnc(c2ccccc2)n1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8921 |
| logD: | 3.892 |
| logSw: | -4.1126 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.477 |
| InChI Key: | HGXBBSWGGOBKIV-UHFFFAOYSA-N |