3-Bromobenzyl 4-ethyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide
4-[5-[(3-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]pyridine
Also Known As: 4-{5-[(3-bromobenzyl)sulfanyl]-4-ethyl-4H-1,2,4-triazol-3-yl}pyridine|4-(5-((3-Bromobenzyl)thio)-4-ethyl-4H-1,2,4-triazol-3-yl)pyridine|3-[(3-bromophenyl)methylthio]-4-ethyl-5-(4-pyridyl)-1,2,4-triazole|3-Bromobenzyl 4-ethyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide|4-[5-[(3-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]pyridine|4-(5-{[(3-bromophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)pyridine|643-705-4
| Molecular Formula | C16H15BrN4S |
|---|---|
| Molecular Weight | 374.02008 g/mol |
| LogP | 4.4148 |
| Topological Polar Surface Area | 43.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 374.02008 |
| Monoisotopic Mass | 374.02008 |
| Heavy Atoms | 22 |
| Complexity | 757.84717 |
Chemical Identifiers
| CAS Number | 577765-94-7 |
|---|---|
| SMILES | CCN1C(=NN=C1SCC2=CC(=CC=C2)Br)C3=CC=NC=C3 |
Product Overview
3-Bromobenzyl 4-ethyl-5-(4-pyridinyl)-4H-1,2,4-triazol-3-YL sulfide (CAS 577765-94-7), with molecular formula C16H15BrN4S and molecular weight 374.02008 g/mol. IUPAC: 4-[5-[(3-bromophenyl)methylsulfanyl]-4-ethyl-1,2,4-triazol-3-yl]pyridine.