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HuagongsheHuagongshe Chemie-Druckbericht · Nur für Forschungszwecke
HRID 1915692Erstellt: 26. Oktober 2026

4-Fluorophenyl isothiocyanate → 4-[2-(4-Fluoro-phenylamino)-1-methyl-1H-benzoimidazol-5-yloxy]-pyridine-2-carboxylic acid tert-butyl ester

https://huagongshe.com/reaction/1915692

Reaktionsgleichung

Beteiligte Stoffe

RolleNameHCIDEinwaage
Edukt4-Fluorophenyl isothiocyanateHCID 15241—
EduktTert-butyl4-[3-amino-4-(methylamino)phenoxy]pyridine-2-carboxylateHCID 22040526—
LösungsmittelMethanolHCID 887—
Produkt4-[2-(4-Fluoro-phenylamino)-1-methyl-1H-benzoimidazol-5-yloxy]-pyridine-2-carboxylic acid tert-butyl esterHCID 21037368—

Reaktionsschritte

A round bottom flask was charged with 4-fluorophenylisothiocyanate (1 eq), 4-(3-Amino-4-methylamino-phenoxy)-pyridine-2-carboxylic acid tert-butyl ester (1 eq), and MeOH. The reaction was maintained stirring at room temperature overnight. Ferric chloride, (1.5 eq) was added and the resulting mixture was stirred overnight. The reaction was partitioned with EtOAc and water, and filtered through Celite. The layers were separated and the aqueous phase was neutralized with saturated Na2CO3 solution. The resulting aqueous phase was extracted with EtOAc and the mixture was filtered through Celite. The phases were separated and the aqueous phase was again extracted and filtered. The combined organic layers were washed with brine, dried over MgSO4, filtered, and concentrated to give a brown solid. The crude residue was purified by trituration in hot toluene to furnish the desired product. LCMS m/z 435.6 (MH+), tR=2.12 min.

Herkunft & Nachweise

DOI10.6084/m9.figshare.5104873.v1
PatentnummerUS08614330B2
Quelldatensatzuspto-grants-2013_12
ORD IDord-fd0f9158e1de4d4e87afb4f6e79576f9
Quellennotizuspto-grants-2013_12