N-(2-chlorophenyl)-2-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-chlorophenyl)-2-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(2-chlorophenyl)-2-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 8016-2519 |
| Compound Name: | N-(2-chlorophenyl)-2-{[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 345.81 |
| Molecular Formula: | C15 H12 Cl N5 O S |
| Smiles: | C(C(Nc1ccccc1[Cl])=O)Sc1nnc(c2ccncc2)[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 1.6625 |
| logD: | 0.6503 |
| logSw: | -2.4986 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.354 |
| InChI Key: | ZKGQZUMSCFGGJJ-UHFFFAOYSA-N |