N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]-1-[4-methoxy-3-(methoxymethyl)phenyl]methanimine
Chemical Structure Depiction of
N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]-1-[4-methoxy-3-(methoxymethyl)phenyl]methanimine
N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]-1-[4-methoxy-3-(methoxymethyl)phenyl]methanimine
Compound characteristics
| Compound ID: | Y503-3954 |
| Compound Name: | N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]-1-[4-methoxy-3-(methoxymethyl)phenyl]methanimine |
| Molecular Weight: | 342.37 |
| Molecular Formula: | C14 H16 F2 N4 O2 S |
| Smiles: | COCc1cc(/C=N/n2c(C(F)F)nnc2SC)ccc1OC |
| Stereo: | ACHIRAL |
| logP: | 1.8455 |
| logD: | 1.845 |
| logSw: | -2.1837 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.931 |
| InChI Key: | DREZRHKGGPKKRX-UHFFFAOYSA-N |