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Sodium Bicarbonate → N-Cyclopropyl-3-[3-(cyclopropylamino)-1,2-benzisoxazol-6-yl]-5-fluoro-4-methylbenzamide

HRID 1988928
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HRID 1988928 반응식
Br[C:2]1[CH:14]=[CH:13][C:5]2[C:6]([NH:9][CH:10]3[CH2:12][CH2:11]3)=[N:7][O:8][C:4]=2[CH:3]=1.[CH:15]1([NH:18][C:19](=[O:37])[C:20]2[CH:25]=[C:24](B3OC(C)(C)C(C)(C)O3)[C:23]([CH3:35])=[C:22]([F:36])[CH:21]=2)[CH2:17][CH2:16]1.C(=O)([O-])O.[Na+]>C(O)(C)C>[CH:15]1([NH:18][C:19](=[O:37])[C:20]2[CH:21]=[C:22]([F:36])[C:23]([CH3:35])=[C:24]([C:2]3[CH:14]=[CH:13][C:5]4[C:6]([NH:9][CH:10]5[CH2:12][CH2:11]5)=[N:7][O:8][C:4]=4[CH:3]=3)[CH:25]=2)[CH2:16][CH2:17]1
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참가 물질

5

반응물 3

HCID 516892Sodium BicarbonateHCID 21914563N-cyclopropyl-3-fluoro-4-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide2회HCID 591273806-bromo-N-cyclopropyl-1,2-benzisoxazol-3-amine2회

생성물 1

HCID 59127377N-Cyclopropyl-3-[3-(cyclopropylamino)-1,2-benzisoxazol-6-yl]-5-fluoro-4-methylbenzamide수율 43.7%

시약·촉매·용매 1

HCID 3776
Isopropanol
용매

실험 절차

A mixture of 6-bromo-N-cyclopropyl-1,2-benzisoxazol-3-amine (Intermediate 53) (0.02 g) N-cyclopropyl-3-fluoro-4-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzamide (Intermediate 62) (0.02 g) saturated aqueous sodium hydrogen carbonate (0.5 ml) and tetrakis(triphenykphosphine)palladium(0) in isopropanol (2 ml) was heated in a microwave at 150° for 10 min. The residue was absorbed onto silica Merck 7734) and applied to a Varian Bond Elut SPE cartridge (silica, 5 g) elutin with cyclohexane:ethyl acetate (75:25 to 0:100) to give the title compound (10 mg).

후처리

  1. temperaturewas heated in a microwave at 150° for 10 min
  2. customThe residue was absorbed onto silica Merck 7734) and

출처 및 근거

ORD 기록
ord-e7ddf22cf8ca4bf4a06830f841a55205
출처 데이터셋
uspto-grants-2010_01
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US07642276B2

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