2-{[4-amino-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dichlorophenyl)acetamide
Chemical Structure Depiction of
2-{[4-amino-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dichlorophenyl)acetamide
2-{[4-amino-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dichlorophenyl)acetamide
Compound characteristics
| Compound ID: | 8012-6850 |
| Compound Name: | 2-{[4-amino-5-(pyridin-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,4-dichlorophenyl)acetamide |
| Molecular Weight: | 395.27 |
| Molecular Formula: | C15 H12 Cl2 N6 O S |
| Smiles: | C(C(Nc1ccc(cc1[Cl])[Cl])=O)Sc1nnc(c2cccnc2)n1N |
| Stereo: | ACHIRAL |
| logP: | 2.0156 |
| logD: | 2.0005 |
| logSw: | -2.9456 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 74.109 |
| InChI Key: | XHAYEPXJJOAFQK-UHFFFAOYSA-N |