5-[4-(difluoromethoxy)-3-ethoxyphenyl]-4-ethyl-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-[4-(difluoromethoxy)-3-ethoxyphenyl]-4-ethyl-4H-1,2,4-triazole-3-thiol
5-[4-(difluoromethoxy)-3-ethoxyphenyl]-4-ethyl-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y500-8633 |
| Compound Name: | 5-[4-(difluoromethoxy)-3-ethoxyphenyl]-4-ethyl-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 315.34 |
| Molecular Formula: | C13 H15 F2 N3 O2 S |
| Smiles: | CCn1c(c2ccc(c(c2)OCC)OC(F)F)nnc1S |
| Stereo: | ACHIRAL |
| logP: | 2.317 |
| logD: | 1.9727 |
| logSw: | -2.5913 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.613 |
| InChI Key: | OQBFKZCMLVFVPC-UHFFFAOYSA-N |