3-Chloro-N-(4-chloro-2-((5-chloropyridin-2-yl)carbamoyl)-6-methoxyphenyl)-4-((2-(methylamino)-1H-imidazol-1-yl)methyl)thiophene-2-carboxamide CAS 229336-92-9
| CAS No. | 229336-92-9 |
| Molecular Formula | C23H19Cl3N6O3S |
| Molecular Weight | 565.86 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.
3-Chloro-N-(4-chloro-2-((5-chloropyridin-2-yl)carbamoyl)-6-methoxyphenyl)-4-((2-(methylamino)-1H-imidazol-1-yl)methyl)thiophene-2-carboxamide (CAS 229336-92-9), molecular formula C23H19Cl3N6O3S and molecular weight 565.86 g/mol, is a CATO reference standard with documented purity and traceability.
Based on its molecular formula C23H19Cl3N6O3S, 3-Chloro-N-(4-chloro-2-((5-chloropyridin-2-yl)carbamoyl)-6-methoxyphenyl)-4-((2-(methylamino)-1H-imidazol-1-yl)methyl)thiophene-2-carboxamide contains a steroid core, an amide group, a sulfone group, a hydroxyl group, an ether linkage, chlorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 565.86 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
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.
Physical & Chemical Properties
| Molecular Formula | C23H19Cl3N6O3S |
| Molecular Weight | 565.86 g/mol |
| Purity | 97%+ |
| Storage | Store in a cool place (≤25°C), protect from light, keep sealed and dry |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 16.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2022 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 6 |
| Sulfur Atoms | 1 |
Related Chloro Standards
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- 3-(2-Bromobenzamido)propanoic acid (CAS 405296-04-0)
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