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HRID 216441作成日:2026年10月25日

Triethylamine → 6-(4-Bromo-2-chloro-phenylamino)-7-fluoro-3h-benzoimidazole-5-carboxylic acid cyclopropylmethoxy-amide

https://huagongshe.com/reaction/216441

反応式

関与物質

役割名称HCID仕込み量
反応物TriethylamineHCID 8471—
反応物1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 15908—
反応物1-HydroxybenzotriazoleHCID 75771—
反応物6-(4-Bromo-2-chloro-phenylamino)-7-fluoro-3H-benzoimidazole-5-carboxylic acidHCID 21114158—
反応物Cyclopropyl methyl hydroxylamine hydrochlorideHCID 21114231—
溶媒WaterHCID 962—
溶媒DimethylformamideHCID 6228—
溶媒Ethyl AcetateHCID 8857—
生成物6-(4-Bromo-2-chloro-phenylamino)-7-fluoro-3h-benzoimidazole-5-carboxylic acid cyclopropylmethoxy-amideHCID 982515789%

反応手順

6-(4-Bromo-2-chloro-phenylamino)-7-fluoro-3H-benzoimidazole-5-carboxylic acid 10b (22 mg, 0.057 mmol) is dissolved in DMF (1 mL) and HOBt (9 mg, 0.062 mmol) followed by triethyl amine (18 μL, 0.132 mmol) is added. Cyclopropyl methyl hydroxylamine hydrochloride (8 mg, 0.062 mmol) is added followed by EDCI (14 mg, 0.074 mmol). After 16 hours, the reaction mixture is diluted with ethyl acetate and water and the layers separated. The organic layer is washed with saturated NH4Cl, brine, saturated NaHCO3, water and brine. The organic layer is dried (MgSO4) and concentrated under reduced pressure to give 23 mg (89%) pure desired product. MS APCI (+) m/z 455, 453 (M+ Br pattern) detected; MS APCI (−) m/z 453, 451 (M− Br pattern) detected; 1H NMR (400 MHz, DMSO-d6) δ 11.69 (broad s, 1H), 8.43 (s, 1H), 7.62 (d, 1H), 7.28 (dd, 1H), 6.42 (m, 1H), 3.63 (d, 2H), 1.03 (m, 1H), 0.48 (m, 2H), 0.19 (m, 2H); 19F NMR (376 MHz, DMSO-d6) −132.95 (s).

情報源と証拠

DOI10.6084/m9.figshare.5104873.v1
特許番号US08193229B2
出典データセットuspto-grants-2012_06
ORD IDord-e7a94e0649504cff8d340c9448a90973
出典メモuspto-grants-2012_06