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HRID 1808191Erstellt: 24. Oktober 2026

Lithium → 3-Fluoro-4-[(1,2,4-thiadiazol-5-ylamino)sulfonyl]benzoic acid

https://huagongshe.com/de/reaction/1808191

Reaktionsgleichung

Beteiligte Stoffe

RolleNameHCIDEinwaage
EduktLithiumHCID 3028194—
Edukt4-(Chlorosulfonyl)-3-fluorobenzoic acidHCID 11310971—
EduktN-(2,4-dimethoxybenzyl)-1,2,4-thiadiazol-5-amineHCID 57732216—
LösungsmittelTetrahydrofuranHCID 8028—
LösungsmittelSodium chloride; waterHCID 57417360—
Produkt3-Fluoro-4-[(1,2,4-thiadiazol-5-ylamino)sulfonyl]benzoic acidHCID 5773206416%

Reaktionsbedingungen

Temperatur-78 °C

Reaktionsschritte

N-(2,4-dimethoxybenzyl)-1,2,4-thiadiazol-5-amine (Preparation 26, 500 mg, 2.1 mmol, 1.0 eq) was dissolved in THF (10 ml) and cooled to −78° C. 1,1,1,3,3,3-Hexanemethyldisilazane lithium salt (LiHMDS, 1M in THF, 4.2 ml, 4.19 mmol, 2.0 eq) was added dropwise and the reaction mixture stirred for a further 10 minutes. A solution of 4-(chlorosulfonyl)-3-fluorobenzoic acid (Preparation 9, 500 mg, 2.1 mmol, 1 eq) in THF (3 ml) was added dropwise and the reaction mixture stirred at −78° C. for 1 hour then at room temperature for 18 hours. The reaction mixture was diluted with brine, extracted into ethyl acetate, dried over sodium sulphate, filtered and evaporated in vacuo. The crude material was passed through a SCX cartridge to remove remaining amine. The material was redissolved in 4M HCl in dioxane and stirred at room temperature for 2 hours. The resulting precipitate was collected by filtration and washed with diethylether to yield the title compound (100 mg, 0.33 mmol, 16%).

Herkunft & Nachweise

DOI10.6084/m9.figshare.5104873.v1
PatentnummerUS08357711B2
Quelldatensatzuspto-grants-2013_01
ORD IDord-5d150023172042c38609c17a69f9decb
Quellennotizuspto-grants-2013_01