N-[3-(butylsulfanyl)-5-(difluoromethyl)-4H-1,2,4-triazol-4-yl]-1-(2-chloro-6-fluorophenyl)methanimine
Chemical Structure Depiction of
N-[3-(butylsulfanyl)-5-(difluoromethyl)-4H-1,2,4-triazol-4-yl]-1-(2-chloro-6-fluorophenyl)methanimine
N-[3-(butylsulfanyl)-5-(difluoromethyl)-4H-1,2,4-triazol-4-yl]-1-(2-chloro-6-fluorophenyl)methanimine
Compound characteristics
| Compound ID: | Y500-7306 |
| Compound Name: | N-[3-(butylsulfanyl)-5-(difluoromethyl)-4H-1,2,4-triazol-4-yl]-1-(2-chloro-6-fluorophenyl)methanimine |
| Molecular Weight: | 362.8 |
| Molecular Formula: | C14 H14 Cl F3 N4 S |
| Smiles: | CCCCSc1nnc(C(F)F)n1/N=C/c1c(cccc1[Cl])F |
| Stereo: | ACHIRAL |
| logP: | 4.0451 |
| logD: | 4.0451 |
| logSw: | -4.2692 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 35.876 |
| InChI Key: | IOGJQDUCFHUJKX-UHFFFAOYSA-N |