1-{5-[(2,6-dichlorophenoxy)methyl]furan-2-yl}-N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]methanimine
Chemical Structure Depiction of
1-{5-[(2,6-dichlorophenoxy)methyl]furan-2-yl}-N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]methanimine
1-{5-[(2,6-dichlorophenoxy)methyl]furan-2-yl}-N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]methanimine
Compound characteristics
| Compound ID: | Y508-8974 |
| Compound Name: | 1-{5-[(2,6-dichlorophenoxy)methyl]furan-2-yl}-N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]methanimine |
| Molecular Weight: | 433.26 |
| Molecular Formula: | C16 H12 Cl2 F2 N4 O2 S |
| Smiles: | CSc1nnc(C(F)F)n1/N=C/c1ccc(COc2c(cccc2[Cl])[Cl])o1 |
| Stereo: | ACHIRAL |
| logP: | 4.2763 |
| logD: | 4.276 |
| logSw: | -4.3506 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.289 |
| InChI Key: | UHSIPOQOJKSDIE-UHFFFAOYSA-N |