3-(benzylsulfanyl)-4-(3,4-dichlorophenyl)-5-(3-methylphenyl)-4H-1,2,4-triazole
Chemical Structure Depiction of
3-(benzylsulfanyl)-4-(3,4-dichlorophenyl)-5-(3-methylphenyl)-4H-1,2,4-triazole
3-(benzylsulfanyl)-4-(3,4-dichlorophenyl)-5-(3-methylphenyl)-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | V030-9654 |
| Compound Name: | 3-(benzylsulfanyl)-4-(3,4-dichlorophenyl)-5-(3-methylphenyl)-4H-1,2,4-triazole |
| Molecular Weight: | 426.37 |
| Molecular Formula: | C22 H17 Cl2 N3 S |
| Salt: | not_available |
| Smiles: | Cc1cccc(c1)c1nnc(n1c1ccc(c(c1)[Cl])[Cl])SCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.7896 |
| logD: | 6.7896 |
| logSw: | -6.5635 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.7125 |
| InChI Key: | BGAYPHTZXDVCOJ-UHFFFAOYSA-N |