5-[4-(difluoromethoxy)-3-ethoxyphenyl]-4-propyl-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-[4-(difluoromethoxy)-3-ethoxyphenyl]-4-propyl-4H-1,2,4-triazole-3-thiol
5-[4-(difluoromethoxy)-3-ethoxyphenyl]-4-propyl-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y500-8788 |
| Compound Name: | 5-[4-(difluoromethoxy)-3-ethoxyphenyl]-4-propyl-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 329.37 |
| Molecular Formula: | C14 H17 F2 N3 O2 S |
| Smiles: | CCCn1c(c2ccc(c(c2)OCC)OC(F)F)nnc1S |
| Stereo: | ACHIRAL |
| logP: | 2.7745 |
| logD: | 2.4301 |
| logSw: | -2.8602 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.866 |
| InChI Key: | CAURIVXRRDHEQF-UHFFFAOYSA-N |