N-allyl-6-(((4-chlorophenyl)thio)methyl)-2-((4-fluorobenzyl)thio)pyrimidin-4-amine CAS 341965-48-8
| CAS No. | 341965-48-8 |
| Molecular Formula | C21H19ClFN3S2 |
| Molecular Weight | 431.98 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
This reference standard is suitable for quantitative analysis on major chromatographic platforms including HPLC, GC, LC-MS/MS, and GC-MS, serving as an external calibration standard or a system suitability test reference material.
N-allyl-6-(((4-chlorophenyl)thio)methyl)-2-((4-fluorobenzyl)thio)pyrimidin-4-amine (CAS 341965-48-8), molecular formula C21H19ClFN3S2 and molecular weight 431.98 g/mol, is a CATO reference standard with documented purity and traceability.
Based on its molecular formula C21H19ClFN3S2, N-allyl-6-(((4-chlorophenyl)thio)methyl)-2-((4-fluorobenzyl)thio)pyrimidin-4-amine contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, fluorine/chlorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 431.98 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.
As a certified reference material (CRM), N-allyl-6-(((4-chlorophenyl)thio)methyl)-2-((4-fluorobenzyl)thio)pyrimidin-4-amine meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.
Physical & Chemical Properties
| Molecular Formula | C21H19ClFN3S2 |
| Molecular Weight | 431.98 g/mol |
| Purity | 97%+ |
| Storage | Store at room temperature, protect from light |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 13.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | F/Cl-containing |
| Nitrogen Atoms | 3 |
| Sulfur Atoms | 2 |
Related N Standards
- 2-((4-Allyl-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-phenoxyphenyl)acetamide (CAS 573694-45-8)
- 1-Allyl-2-((4-fluorobenzyl)sulfonyl)-4,5-diphenyl-1H-imidazole (CAS 339277-78-0)
- 3-(4-Allyl-5-(prop-2-yn-1-ylthio)-4H-1,2,4-triazol-3-yl)-1-(3,4-dichlorobenzyl)pyridin-2(1H)-one (CAS 477853-25-1)
- N-allyl-2-((4-chloro-N-(3-(trifluoromethyl)phenyl)phenyl)sulfonamido)acetamide (CAS 337922-21-1)
- 3-(4-Allyl-5-(allylthio)-4H-1,2,4-triazol-3-yl)-1-(2,4-dichlorobenzyl)pyridin-2(1H)-one (CAS 477853-07-9)
- 2-((4-Allyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-sulfamoylphenyl)acetamide (CAS 578761-02-1)
- 5-(1-Allyl-2-oxoindolin-3-ylidene)-2-(4-ethoxyphenyl)thiazolo[3,2-b][1,2,4]triazol-6(5H)-one (CAS 538340-83-9)
- 2-((4-Allyl-5-(pyridin-2-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(2-bromophenyl)acetamide (CAS 573933-57-0)
Recommended Standards
- 2-((5-(2-Chlorophenyl)-4-cyclopentyl-4H-1,2,4-triazol-3-yl)thio)-N-(2-cyano-3-methylbutan-2-yl)acetamide (CAS 757216-11-8)
- N-Benzyl-6-({[(4-chlorophenyl)methyl]sulfanyl}methyl)-2-phenylpyrimidin-4-amine (CAS 338967-31-0)
- Losartan-d9 (CAS 1030937-18-8)
- 3,5-Diiodo-4-hydroxyphenylacetic Acid Ethyl Ester (CAS 90917-49-0)
- Bismuth aluminate hydrate,99.9% (CAS 308796-32-9)
- 2-(3-cyclopropyl-2-oxoimidazolidin-1-yl)acetic acid (CAS 1520471-33-3)
- 951889-30-8 2-Bromo-3-[(2-trifluoromethyl)phenyl]-1-propene MFCD09801105 (CAS 951889-30-8)
- 2-Ethynyl-1,2,3,4-tetrahydronaphthalen-2-ol (CAS 94616-81-6)
- 7-Bromo-3-iodocinnolin-4(1H)-one (CAS 2765161-40-6)
- N-cyclopentyl-3-nitroaniline (CAS 1153353-96-8)
- Ethyl (E)-7-(2-ethoxyprop-1-en-1-yl)-2-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylate (CAS 1374510-88-9)
- 4-ethynyl-4-methoxyoxane (CAS 1044277-49-7)
- 1-[5-(1-benzothiophen-5-yl)furan-2-yl]ethan-1-one (CAS 1490665-95-6)
- Tirzepatide Impurity 10 (CAS CATO-C4X-324010)
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