3-(2-chlorophenyl)-5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-(2-fluorophenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(2-chlorophenyl)-5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-(2-fluorophenyl)-4H-1,2,4-triazole
3-(2-chlorophenyl)-5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-(2-fluorophenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V023-2623 |
| Compound Name: | 3-(2-chlorophenyl)-5-{[(2,5-dimethylphenyl)methyl]sulfanyl}-4-(2-fluorophenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 423.94 |
| Molecular Formula: | C23 H19 Cl F N3 S |
| Salt: | not_available |
| Smiles: | Cc1ccc(C)c(CSc2nnc(c3ccccc3[Cl])n2c2ccccc2F)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.8023 |
| logD: | 6.8023 |
| logSw: | -6.5484 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.4116 |
| InChI Key: | HSSIYLUKECXEHF-UHFFFAOYSA-N |