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Methyl 2-([3-Cyano-4-(4-Fluorophenyl)-2-Pyridinyl]Sulfanyl)Benzenecarboxylate CAS NO 478245-93-1
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CAS No.:478245-93-1
Grade:Pharmacy Grade
Content:99.9%
Brand:Customizable
Packaging:Customizable
Description
Methyl 2-([3-Cyano-4-(4-Fluorophenyl)-2-Pyridinyl]Sulfanyl)Benzenecarboxylate is a high-value, non-steroidal anti-inflammatory drug (NSAID) intermediate with a complex heterocyclic structure. This compound is critical for the synthesis of advanced pharmaceutical agents, particularly those targeting cyclooxygenase-2 (COX-2) inhibition. It is primarily sought by research institutions and pharmaceutical manufacturers engaged in the development and production of next-generation analgesic and anti-inflammatory medications.
Application
- Key Intermediate in NSAID Synthesis: Serves as a crucial building block in the multi-step synthesis of selective COX-2 inhibitor drugs, such as Celecoxib analogs.
- Pharmaceutical Research & Development (R&D): Used in medicinal chemistry for structure-activity relationship (SAR) studies and the development of novel anti-inflammatory compounds.
- Active Pharmaceutical Ingredient (API) Manufacturing: Employed in the scaled-up production of finished dosage forms for targeted pain and inflammation management.
- Contract Manufacturing Organizations (CMOs): Supplied to CMOs specializing in the production of complex, patent-protected pharmaceutical intermediates.
- Academic Research: Utilized in university and institutional labs for biochemical studies related to inflammation pathways and drug mechanisms.
Basic Information
| Product Name | Methyl 2-([3-Cyano-4-(4-Fluorophenyl)-2-Pyridinyl]Sulfanyl)Benzenecarboxylate |
| CAS No. | 478245-93-1 |
| Molecular Formula | C20H13FN2O2S |
| Molecular Weight | 364.40 g/mol |
| Synonyms | Methyl 2-((3-Cyano-4-(4-fluorophenyl)pyridin-2-yl)thio)benzoate; 2-[(3-Cyano-4-(4-fluorophenyl)-2-pyridinyl)sulfanyl]-Benzoic Acid Methyl Ester; Celecoxib Intermediate; COX-2 Inhibitor Intermediate; 4-[4-(Fluorophenyl)-3-(methylsulfonyl)phenyl]-3-(trifluoromethyl)-1H-pyrazole; A known precursor in Celecoxib synthesis. |
| EINECS | Contact for details |
Quality Control
Our production of this pharmaceutical intermediate adheres to strict cGMP (current Good Manufacturing Practice) guidelines to ensure batch-to-batch consistency and traceability. Every lot undergoes comprehensive analytical testing, including HPLC for purity and identity confirmation and stringent control of residual solvents and impurities. A comprehensive Certificate of Analysis (COA) detailing all specifications and test results is provided with each shipment.
Storage
Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at a controlled room temperature (typically 15-25°C). Keep the container sealed to protect from moisture. Store away from incompatible materials.
Specification
| Item | Specification |
|---|---|
| Appearance | White to off-white crystalline powder |
| Identification (IR) | Conforms to structure |
| Identification (HPLC) | Retention time matches reference standard |
| Assay (HPLC) | ≥ 98.0% |
| Related Substances (HPLC) | Total impurities ≤ 2.0% Any single impurity ≤ 0.5% |
| Residual Solvents (GC) | Meets ICH Q3C guidelines |
| Loss on Drying | ≤ 0.5% |
Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.
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