methyl [(4-ethyl-5-{[3-(trifluoromethyl)phenoxy]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetate
Chemical Structure Depiction of
methyl [(4-ethyl-5-{[3-(trifluoromethyl)phenoxy]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetate
methyl [(4-ethyl-5-{[3-(trifluoromethyl)phenoxy]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | Y205-7424 |
| Compound Name: | methyl [(4-ethyl-5-{[3-(trifluoromethyl)phenoxy]methyl}-4H-1,2,4-triazol-3-yl)sulfanyl]acetate |
| Molecular Weight: | 375.37 |
| Molecular Formula: | C15 H16 F3 N3 O3 S |
| Smiles: | CCn1c(COc2cccc(c2)C(F)(F)F)nnc1SCC(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.6907 |
| logD: | 2.6907 |
| logSw: | -2.8544 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.291 |
| InChI Key: | MCOZUGGJJOCVNX-UHFFFAOYSA-N |