≥97% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Normal Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Canonical Smiles | CC1=CC(=CC(=C1)N2C(=NNC2=S)C3=C(C4=C(S3)N=CC=C4)N)C |
|---|---|
| IUPAC Name | 3-(3-aminothieno[2,3-b]pyridin-2-yl)-4-(3,5-dimethylphenyl)-1H-1,2,4-triazole-5-thione |
| InChIKey | OWUJLKJUGYVWKO-UHFFFAOYSA-N |
| INCHI | 1S/C17H15N5S2/c1-9-6-10(2)8-11(7-9)22-15(20-21-17(22)23)14-13(18)12-4-3-5-19-16(12)24-14/h3-8H,18H2,1-2H3,(H,21,23) |
| Molecular Weight | 353.5 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Azoles |
| Subclass | Triazoles |
| Intermediate Tree Nodes | Phenyltriazoles |
| Direct Parent | Phenyl-1,2,4-triazoles |
| Alternative Parents | Thienopyridines m-Xylenes Pyridines and derivatives Aminothiophenes Triazolines Heteroaromatic compounds Azacyclic compounds Primary amines Organosulfur compounds Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Phenyl-1,2,4-triazole - Thienopyridine - M-xylene - Xylene - Aminothiophene - Monocyclic benzene moiety - Pyridine - Benzenoid - Triazoline - Heteroaromatic compound - Thiophene - Azacycle - Hydrocarbon derivative - Primary amine - Organosulfur compound - Organonitrogen compound - Amine - Organic nitrogen compound - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as phenyl-1,2,4-triazoles. These are organic compounds containing a 1,2,4-triazole substituted by a phenyl group. |
| External Descriptors | Not available |
| Molecular Weight | 353.500 g/mol |
|---|---|
| XLogP3 | 3.900 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 2 |
| Exact Mass | 353.077 Da |
| Monoisotopic Mass | 353.077 Da |
| Topological Polar Surface Area | 127.000 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 529.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
![5-(3-aminothieno[2,3-b]pyridin-2-yl)-4-(3,5-dimethylphenyl)-4H-1,2,4-triazole-3-thiol - ≥97% , CAS No.1114597-32-8](https://www.aladdinsci.com/media/catalog/product/placeholder/default/default_4.jpg)