Determine the necessary mass, volume, or concentration for preparing a solution.
| Activity Type | Activity Value -log(M) | Mechanism of Action | Activity Reference | Publications (PubMed IDs) |
|---|
Moligand™, ≥98%(HPLC) Moligand™ for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Store at -20°C Ships Ice chest + Ice pads 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.
| Pubchem Sid | 504760652 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/504760652 |
| Sonrisas canónicas | CCCCCCSC1=NC(=CC(=O)N1)O |
| IUPAC Name | 2-hexylsulfanyl-4-hydroxy-1H-pyrimidin-6-one |
| InChIKey | UYXOAKRMLQKLQX-UHFFFAOYSA-N |
| INCHI | 1S/C10H16N2O2S/c1-2-3-4-5-6-15-10-11-8(13)7-9(14)12-10/h7H,2-6H2,1H3,(H2,11,12,13,14) |
| Isómeros SMILES | CCCCCCSC1=NC(=CC(=O)N1)O |
| PubChem CID | 1912564 |
| Términos de entrada MeSH | 2-(hexylthio)pyrimidine-4,6-diol;ZA-16 compound |
| Peso molecular | 228.31 |
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 | Organosulfur compounds |
| Clase | Thioethers |
| Subclass | Aryl thioethers |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Aryl thioethers |
| Alternative Parents | Pyrimidones Hydroxypyrimidines Alkylarylthioethers Hydropyrimidines Vinylogous acids Heteroaromatic compounds Lactams Sulfenyl compounds Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteromonocyclic compounds |
| Substituents | Aryl thioether - Pyrimidone - Hydroxypyrimidine - Alkylarylthioether - Hydropyrimidine - Pyrimidine - Heteroaromatic compound - Vinylogous acid - Lactam - Sulfenyl compound - Azacycle - Organoheterocyclic compound - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as aryl thioethers. These are organosulfur compounds containing a thioether group that is substituted by an aryl group. |
| External Descriptors | Not available |
| Activity Type | Activity Value -log(M) | Mechanism of Action | Activity Reference | Publications (PubMed IDs) |
|---|
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
| Certificate of Analysis | May 18, 2026 | Z287970 | |
| Certificate of Analysis | May 18, 2026 | Z287970 | |
| Certificate of Analysis | May 18, 2026 | Z287970 | |
| Certificate of Analysis | May 18, 2026 | Z287970 | |
| Certificate of Analysis | May 18, 2026 | Z287970 | |
| Certificate of Analysis | May 18, 2026 | Z287970 | |
| Certificate of Analysis | May 18, 2026 | Z287970 | |
| Certificate of Analysis | May 18, 2026 | Z287970 | |
| Certificate of Analysis | May 18, 2026 | Z287970 | |
| Certificate of Analysis | May 18, 2026 | Z287970 |
| Solubilidad | Solvent:DMSO, Max Conc. mg/mL: 11.42, Max Conc. mM: 50; Solvent:ethanol, Max Conc. mg/mL: 22.83, Max Conc. mM: 100 |
|---|---|
| Peso molecular | 228.310 g/mol |
| XLogP3 | 2.400 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 6 |
| Exact Mass | 228.093 Da |
| Monoisotopic Mass | 228.093 Da |
| Topological Polar Surface Area | 87.000 Ų |
| Heavy Atom Count | 15 |
| Formal Charge | 0 |
| Complexity | 287.000 |
| 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 |
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