3-[(2-chlorophenoxy)methyl]-4-ethyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-[(2-chlorophenoxy)methyl]-4-ethyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
3-[(2-chlorophenoxy)methyl]-4-ethyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-8683 |
| Compound Name: | 3-[(2-chlorophenoxy)methyl]-4-ethyl-5-({[3-(trifluoromethyl)phenyl]methyl}sulfanyl)-4H-1,2,4-triazole |
| Molecular Weight: | 427.87 |
| Molecular Formula: | C19 H17 Cl F3 N3 O S |
| Smiles: | CCn1c(COc2ccccc2[Cl])nnc1SCc1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 5.0011 |
| logD: | 5.0011 |
| logSw: | -5.2837 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 32.527 |
| InChI Key: | MKCOZBSGOBHAQV-UHFFFAOYSA-N |