N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]-1-(4-fluorophenyl)methanimine
Chemical Structure Depiction of
N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]-1-(4-fluorophenyl)methanimine
N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]-1-(4-fluorophenyl)methanimine
Compound characteristics
| Compound ID: | Y503-3953 |
| Compound Name: | N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]-1-(4-fluorophenyl)methanimine |
| Molecular Weight: | 286.28 |
| Molecular Formula: | C11 H9 F3 N4 S |
| Smiles: | CSc1nnc(C(F)F)n1/N=C/c1ccc(cc1)F |
| Stereo: | ACHIRAL |
| logP: | 1.9754 |
| logD: | 1.975 |
| logSw: | -1.9395 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 35.876 |
| InChI Key: | QFPGYQAVULQQKO-UHFFFAOYSA-N |