5-(2-fluorophenyl)-4-(naphthalen-1-yl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-(2-fluorophenyl)-4-(naphthalen-1-yl)-4H-1,2,4-triazole-3-thiol
5-(2-fluorophenyl)-4-(naphthalen-1-yl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8013-8014 |
| Compound Name: | 5-(2-fluorophenyl)-4-(naphthalen-1-yl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 321.37 |
| Molecular Formula: | C18 H12 F N3 S |
| Smiles: | c1ccc(c(c1)c1nnc(n1c1cccc2ccccc12)S)F |
| Stereo: | ACHIRAL |
| logP: | 4.2426 |
| logD: | 3.1667 |
| logSw: | -4.5657 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 22.8852 |
| InChI Key: | MCIIIGBFWVUPLT-UHFFFAOYSA-N |