1-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[3-(ethylsulfanyl)-5-methyl-4H-1,2,4-triazol-4-yl]methanimine
Chemical Structure Depiction of
1-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[3-(ethylsulfanyl)-5-methyl-4H-1,2,4-triazol-4-yl]methanimine
1-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[3-(ethylsulfanyl)-5-methyl-4H-1,2,4-triazol-4-yl]methanimine
Compound characteristics
Compound ID: | Y508-8846 |
Compound Name: | 1-[4-(difluoromethoxy)-3-methoxyphenyl]-N-[3-(ethylsulfanyl)-5-methyl-4H-1,2,4-triazol-4-yl]methanimine |
Molecular Weight: | 342.37 |
Molecular Formula: | C14 H16 F2 N4 O2 S |
Smiles: | CCSc1nnc(C)n1/N=C/c1ccc(c(c1)OC)OC(F)F |
Stereo: | ACHIRAL |
logP: | 1.9632 |
logD: | 1.962 |
logSw: | -2.4129 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 50.976 |
InChI Key: | LYIXMLHJJSSIPX-UHFFFAOYSA-N |