N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]-1-[4-methoxy-3-(phenoxymethyl)phenyl]methanimine
Chemical Structure Depiction of
N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]-1-[4-methoxy-3-(phenoxymethyl)phenyl]methanimine
N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]-1-[4-methoxy-3-(phenoxymethyl)phenyl]methanimine
Compound characteristics
| Compound ID: | Y502-4722 |
| Compound Name: | N-[3-(difluoromethyl)-5-(methylsulfanyl)-4H-1,2,4-triazol-4-yl]-1-[4-methoxy-3-(phenoxymethyl)phenyl]methanimine |
| Molecular Weight: | 404.44 |
| Molecular Formula: | C19 H18 F2 N4 O2 S |
| Smiles: | COc1ccc(/C=N/n2c(C(F)F)nnc2SC)cc1COc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4045 |
| logD: | 3.404 |
| logSw: | -3.6872 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.735 |
| InChI Key: | IYRZUKFFSYUXED-UHFFFAOYSA-N |