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Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
HRID 1178002생성일: 2026년 10월 27일

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide → 4-benzyloxy-N-{1,1-dimethyl-2-oxo-2-[4-(2-trifluoromethyl-benzoyl)-piperazin-1-yl]-ethyl}-benzamide

https://huagongshe.com/reaction/1178002

반응식

참여 물질

역할이름HCID투입량
반응물1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 15908—
반응물1-HydroxybenzotriazoleHCID 75771—
반응물DiisopropylethylamineHCID 81531—
반응물1-(2-Trifluoromethylbenzoyl)piperazine hydrochlorideHCID 16733783—
반응물2-(4-Benzyloxy-benzoylamino)-2-methyl-propionic acidHCID 57855664—
용매WaterHCID 962—
용매DimethylformamideHCID 6228—
생성물4-benzyloxy-N-{1,1-dimethyl-2-oxo-2-[4-(2-trifluoromethyl-benzoyl)-piperazin-1-yl]-ethyl}-benzamideHCID 5955960750.2%

반응 단계

DIPEA (284 mg, 0.19 mL, 1.62 mmol) was added to a stirred solution of 2-(4-benzyloxy-benzoylamino)-2-methyl-propionic acid (170 mg, 0.54 mmol) in DMF (2 mL). HOBT (88 mg, 0.65 mmol) and EDCI (125 mg, 0.65 mmol) were then added at room temperature. After 2 minutes, piperazin-1-yl-(2-trifluoromethyl-phenyl)-methanone hydrochloride salt (192 mg, 0.65 mmol) was added and the resulting mixture was stirred at room temperature overnight. Cold water was then added and filtered the solid precipitated out to afford 150 mg (50% yield) of 4-benzyloxy-N-{1,1-dimethyl-2-oxo-2-[4-(2-trifluoromethyl-benzoyl)-piperazin-1-yl]-ethyl}-benzamide. LCMS Purity: 93.29%. 1H NMR (DMSO-d6): δ 8.4 (bs, 1H), 7.6-7.8 (m, 5H), 7.4 (m, 6H), 7.0-7.1 (d, 2H), 5.2 (m, 2H), 3.5 (m, 5H), 3.0 (m, 3H), 1.4 (s, 6H).

출처 및 근거

DOI10.6084/m9.figshare.5104873.v1
특허 번호US07842696B2
출처 데이터셋uspto-grants-2010_11
ORD IDord-70f54ed9e03b4e659104debb51e72d80
출처 메모uspto-grants-2010_11