1-(3-chloro-2-methylphenyl)-5-[4-(methylsulfanyl)phenyl]-1H-1,2,4-triazole
Chemical Structure Depiction of
1-(3-chloro-2-methylphenyl)-5-[4-(methylsulfanyl)phenyl]-1H-1,2,4-triazole
1-(3-chloro-2-methylphenyl)-5-[4-(methylsulfanyl)phenyl]-1H-1,2,4-triazole
Compound characteristics
| Compound ID: | 4073-0008 |
| Compound Name: | 1-(3-chloro-2-methylphenyl)-5-[4-(methylsulfanyl)phenyl]-1H-1,2,4-triazole |
| Molecular Weight: | 315.82 |
| Molecular Formula: | C16 H14 Cl N3 S |
| Smiles: | Cc1c(cccc1[Cl])n1c(c2ccc(cc2)SC)ncn1 |
| Stereo: | ACHIRAL |
| logP: | 5.2126 |
| logD: | 5.2126 |
| logSw: | -5.8486 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.5292 |
| InChI Key: | VEQTUBLVWJMISM-UHFFFAOYSA-N |