3-benzyl-5-{[(2-fluorophenyl)methyl]sulfanyl}-4-(2-methylphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-benzyl-5-{[(2-fluorophenyl)methyl]sulfanyl}-4-(2-methylphenyl)-4H-1,2,4-triazole
3-benzyl-5-{[(2-fluorophenyl)methyl]sulfanyl}-4-(2-methylphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V005-1416 |
| Compound Name: | 3-benzyl-5-{[(2-fluorophenyl)methyl]sulfanyl}-4-(2-methylphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 389.49 |
| Molecular Formula: | C23 H20 F N3 S |
| Smiles: | Cc1ccccc1n1c(Cc2ccccc2)nnc1SCc1ccccc1F |
| Stereo: | ACHIRAL |
| logP: | 5.6682 |
| logD: | 5.6681 |
| logSw: | -5.6526 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 25.3877 |
| InChI Key: | BOVSJYMUFFMOBU-UHFFFAOYSA-N |