戻る
化工社化工社 化学情報印刷レポート · 研究参考用
HRID 2415424作成日:2026年10月27日

(2S)-N-[3-(Trifluoromethyl)-4-cyanophenyl]-2-methyloxirane-2alpha-carboxamide → Bicalutamide

https://huagongshe.com/reaction/2415424

反応式

関与物質

役割名称HCID仕込み量
反応物(2S)-N-[3-(Trifluoromethyl)-4-cyanophenyl]-2-methyloxirane-2alpha-carboxamideHCID 23525848—
反応物CID 131724648HCID 131724648—
触媒Tetrabutylammonium BromideHCID 74236—
溶媒WaterHCID 962—
溶媒ChloroformHCID 6212—
生成物BicalutamideHCID 2375—

反応手順

180 mg of the chiral epoxide of example 17 was dissolved in a mixture of 12 ml chloroform and 12 ml of water. 133 mg of sodium-p-fluorobenzenesulfinate and 107 mg of tetrabutylammonium bromide were added. The reaction mixture was heated till reflux and kept at reflux, while stirring vigorously. The reaction was monitored with HPLC. After 4 days at reflux, the starting epoxide was completely converted. The mixture was cooled to room temperature. 10 ml of chloroform was added. The organic layer was washed with 3×20 ml of water, dried (Na2SO4), filtrated and evaporated to dryness. Residue: 226 mg (brown oil). Purification of the residue by column chromatography (Merck silica gel 60; eluens: heptane/ethyl acetate=1/1) afforded R-enantiomer of bicalutamide as a white/yellow solid material. Purified yield: 122 mg (43%). HPLC: 96.3% purity. HPLC (chiral column): 94.7% e.e. 1H and 13C NMR in agreement with R-bicalutamide

情報源と証拠

DOI10.6084/m9.figshare.5104873.v1
特許番号US06818766B2
出典データセットuspto-grants-2004_11
ORD IDord-571cab5b0ec2416fa2ae55e07ee76dad
出典メモuspto-grants-2004_11