5-(2,3-difluorophenyl)-4-methyl-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-(2,3-difluorophenyl)-4-methyl-4H-1,2,4-triazole-3-thiol
5-(2,3-difluorophenyl)-4-methyl-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | 8020-0943 |
| Compound Name: | 5-(2,3-difluorophenyl)-4-methyl-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 227.23 |
| Molecular Formula: | C9 H7 F2 N3 S |
| Smiles: | Cn1c(c2cccc(c2F)F)nnc1S |
| Stereo: | ACHIRAL |
| logP: | 1.8175 |
| logD: | 1.187 |
| logSw: | -2.173 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 23.796 |
| InChI Key: | MDNRJKFZFQQVAI-UHFFFAOYSA-N |