4-({[4-(difluoromethoxy)phenyl]methylidene}amino)-5-(difluoromethyl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-({[4-(difluoromethoxy)phenyl]methylidene}amino)-5-(difluoromethyl)-4H-1,2,4-triazole-3-thiol
4-({[4-(difluoromethoxy)phenyl]methylidene}amino)-5-(difluoromethyl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y508-9877 |
| Compound Name: | 4-({[4-(difluoromethoxy)phenyl]methylidene}amino)-5-(difluoromethyl)-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 320.27 |
| Molecular Formula: | C11 H8 F4 N4 O S |
| Smiles: | C(\c1ccc(cc1)OC(F)F)=N/n1c(C(F)F)nnc1S |
| Stereo: | ACHIRAL |
| logP: | 1.4424 |
| logD: | 0.6965 |
| logSw: | -1.7422 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.955 |
| InChI Key: | BCXCEXHGKHHBIA-UHFFFAOYSA-N |