4-methyl-5-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-methyl-5-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-4H-1,2,4-triazole-3-thiol
4-methyl-5-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y502-4825 |
| Compound Name: | 4-methyl-5-[3-(1,1,2,2-tetrafluoroethoxy)phenyl]-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 307.27 |
| Molecular Formula: | C11 H9 F4 N3 O S |
| Smiles: | Cn1c(c2cccc(c2)OC(C(F)F)(F)F)nnc1S |
| Stereo: | ACHIRAL |
| logP: | 2.5605 |
| logD: | 1.93 |
| logSw: | -2.6566 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.8179 |
| InChI Key: | CYDHZTWNEXFCFM-UHFFFAOYSA-N |