N-(2,6-dichlorophenyl)-2-{[4-ethyl-5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2,6-dichlorophenyl)-2-{[4-ethyl-5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(2,6-dichlorophenyl)-2-{[4-ethyl-5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y205-6484 |
| Compound Name: | N-(2,6-dichlorophenyl)-2-{[4-ethyl-5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 425.31 |
| Molecular Formula: | C18 H15 Cl2 F N4 O S |
| Smiles: | CCn1c(c2ccc(cc2)F)nnc1SCC(Nc1c(cccc1[Cl])[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.9871 |
| logD: | 4.977 |
| logSw: | -5.0938 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.719 |
| InChI Key: | WJETUCMUEDTRET-UHFFFAOYSA-N |