5-(2,5-difluorophenyl)-4-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-(2,5-difluorophenyl)-4-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}-4H-1,2,4-triazole-3-thiol
5-(2,5-difluorophenyl)-4-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8020-0926 |
| Compound Name: | 5-(2,5-difluorophenyl)-4-{4-[(1H-1,2,4-triazol-1-yl)methyl]phenyl}-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 370.38 |
| Molecular Formula: | C17 H12 F2 N6 S |
| Smiles: | C(c1ccc(cc1)n1c(c2cc(ccc2F)F)nnc1S)n1cncn1 |
| Stereo: | ACHIRAL |
| logP: | 2.2732 |
| logD: | 0.7306 |
| logSw: | -2.5423 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.435 |
| InChI Key: | HWHFMXWXDHXWGJ-UHFFFAOYSA-N |