N-[3-(benzylsulfanyl)-4H-1,2,4-triazol-4-yl]-1-(2-fluorophenyl)methanimine
Chemical Structure Depiction of
N-[3-(benzylsulfanyl)-4H-1,2,4-triazol-4-yl]-1-(2-fluorophenyl)methanimine
N-[3-(benzylsulfanyl)-4H-1,2,4-triazol-4-yl]-1-(2-fluorophenyl)methanimine
Compound characteristics
| Compound ID: | K060-0100 |
| Compound Name: | N-[3-(benzylsulfanyl)-4H-1,2,4-triazol-4-yl]-1-(2-fluorophenyl)methanimine |
| Molecular Weight: | 312.37 |
| Molecular Formula: | C16 H13 F N4 S |
| Smiles: | C(c1ccccc1)Sc1nncn1/N=C/c1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 3.1525 |
| logD: | 3.1523 |
| logSw: | -2.9892 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 34.643 |
| InChI Key: | YLRJZVYYWKRYDA-UHFFFAOYSA-N |