1-{5-[(3-chloro-4-fluorophenoxy)methyl]furan-2-yl}-N-[3-(difluoromethyl)-5-(ethylsulfanyl)-4H-1,2,4-triazol-4-yl]methanimine
Chemical Structure Depiction of
1-{5-[(3-chloro-4-fluorophenoxy)methyl]furan-2-yl}-N-[3-(difluoromethyl)-5-(ethylsulfanyl)-4H-1,2,4-triazol-4-yl]methanimine
1-{5-[(3-chloro-4-fluorophenoxy)methyl]furan-2-yl}-N-[3-(difluoromethyl)-5-(ethylsulfanyl)-4H-1,2,4-triazol-4-yl]methanimine
Compound characteristics
| Compound ID: | Y508-8835 |
| Compound Name: | 1-{5-[(3-chloro-4-fluorophenoxy)methyl]furan-2-yl}-N-[3-(difluoromethyl)-5-(ethylsulfanyl)-4H-1,2,4-triazol-4-yl]methanimine |
| Molecular Weight: | 430.83 |
| Molecular Formula: | C17 H14 Cl F3 N4 O2 S |
| Smiles: | CCSc1nnc(C(F)F)n1/N=C/c1ccc(COc2ccc(c(c2)[Cl])F)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.1826 |
| logD: | 4.1824 |
| logSw: | -4.4201 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.116 |
| InChI Key: | LDMKLQKWAINFKF-UHFFFAOYSA-N |