3-benzyl-5-{[(2-fluorophenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-benzyl-5-{[(2-fluorophenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazole
3-benzyl-5-{[(2-fluorophenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-8558 |
| Compound Name: | 3-benzyl-5-{[(2-fluorophenyl)methyl]sulfanyl}-4-methyl-4H-1,2,4-triazole |
| Molecular Weight: | 313.39 |
| Molecular Formula: | C17 H16 F N3 S |
| Smiles: | Cn1c(Cc2ccccc2)nnc1SCc1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 3.7364 |
| logD: | 3.7364 |
| logSw: | -3.9788 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 26.027 |
| InChI Key: | JWZDVQOJDYOPAD-UHFFFAOYSA-N |