2-{[4-amino-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-difluorophenyl)acetamide
Chemical Structure Depiction of
2-{[4-amino-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-difluorophenyl)acetamide
2-{[4-amino-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-difluorophenyl)acetamide
Compound characteristics
| Compound ID: | Y502-5601 |
| Compound Name: | 2-{[4-amino-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,5-difluorophenyl)acetamide |
| Molecular Weight: | 362.36 |
| Molecular Formula: | C15 H12 F2 N6 O S |
| Smiles: | C(C(Nc1cc(ccc1F)F)=O)Sc1nnc(c2ccncc2)n1N |
| Stereo: | ACHIRAL |
| logP: | 1.4727 |
| logD: | 1.4625 |
| logSw: | -1.9187 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 74.019 |
| InChI Key: | VLMILPPJVDMNLL-UHFFFAOYSA-N |