4-benzyl-5-(quinolin-2-yl)-4H-1,2,4-triazole-3-thiol
4-benzyl-3-quinolin-2-yl-1H-1,2,4-triazole-5-thione
Also Known As: 4-benzyl-3-quinolin-2-yl-1H-1,2,4-triazole-5-thione|4-benzyl-5-(quinolin-2-yl)-4H-1,2,4-triazole-3-thiol|4-Benzyl-5-quinolin-2-yl-4H-[1,2,4]triazole-3-thiol|A3334/0141614|4-benzyl-5-(quinolin-2-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione|4-BENZYL-3-(QUINOLIN-2-YL)-4,5-DIHYDRO-1H-1,2,4-TRIAZOLE-5-THIONE
CAS: 676154-53-3
| Molecular Formula | C18H14N4S |
|---|---|
| Molecular Weight | 318.0939 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 72.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 318.0939 |
| Monoisotopic Mass | 318.0939 |
| Heavy Atoms | 23 |
| Complexity | 472.0 |
Chemical Identifiers
| CAS Number | 676154-53-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=NNC2=S)C3=NC4=CC=CC=C4C=C3 |
| InChIKey | WKKGAWDDMRVQJC-UHFFFAOYSA-N |
Product Overview
4-benzyl-5-(quinolin-2-yl)-4H-1,2,4-triazole-3-thiol (CAS 676154-53-3), with molecular formula C18H14N4S and molecular weight 318.0939 g/mol. IUPAC: 4-benzyl-3-quinolin-2-yl-1H-1,2,4-triazole-5-thione.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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4-benzyl-5-(quinolin-2-yl)-4H-1,2,4-triazole-3-thiol is a custom synthesis product. We offer services from milligram to kilogram scale.
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