2-{[4-ethyl-5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-phenylethyl)acetamide
Chemical Structure Depiction of
2-{[4-ethyl-5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-phenylethyl)acetamide
2-{[4-ethyl-5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-phenylethyl)acetamide
Compound characteristics
| Compound ID: | Y205-6480 |
| Compound Name: | 2-{[4-ethyl-5-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-phenylethyl)acetamide |
| Molecular Weight: | 384.47 |
| Molecular Formula: | C20 H21 F N4 O S |
| Smiles: | CCn1c(c2ccc(cc2)F)nnc1SCC(NCCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3145 |
| logD: | 3.3145 |
| logSw: | -3.5588 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.278 |
| InChI Key: | DEKVDRMMQCOTTJ-UHFFFAOYSA-N |