3-(benzylsulfanyl)-5-(2-fluorophenyl)-4-phenyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(benzylsulfanyl)-5-(2-fluorophenyl)-4-phenyl-4H-1,2,4-triazole
3-(benzylsulfanyl)-5-(2-fluorophenyl)-4-phenyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V008-0078 |
| Compound Name: | 3-(benzylsulfanyl)-5-(2-fluorophenyl)-4-phenyl-4H-1,2,4-triazole |
| Molecular Weight: | 361.44 |
| Molecular Formula: | C21 H16 F N3 S |
| Salt: | not_available |
| Smiles: | C(c1ccccc1)Sc1nnc(c2ccccc2F)n1c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.7625 |
| logD: | 4.7625 |
| logSw: | -4.9221 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.7125 |
| InChI Key: | WNDGDWCROTUDRK-UHFFFAOYSA-N |