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Ammonium Hydroxide → 1-[2-(4-tert-butyl-benzenesulfonylamino)-5-chloro-phenyl]-1H-pyrazole-4-carboxylic acid amide

HRID 502809
ノート
印刷プレビュー

反応式

HRID 502809 の反応式
C([O:3][C:4]([C:6]1[CH:7]=[N:8][N:9]([C:11]2[CH:16]=[C:15]([Cl:17])[CH:14]=[CH:13][C:12]=2[NH:18][S:19]([C:22]2[CH:27]=[CH:26][C:25]([C:28]([CH3:31])([CH3:30])[CH3:29])=[CH:24][CH:23]=2)(=[O:21])=[O:20])[CH:10]=1)=O)C.[OH-].[NH4+:33]>>[C:28]([C:25]1[CH:26]=[CH:27][C:22]([S:19]([NH:18][C:12]2[CH:13]=[CH:14][C:15]([Cl:17])=[CH:16][C:11]=2[N:9]2[CH:10]=[C:6]([C:4]([NH2:33])=[O:3])[CH:7]=[N:8]2)(=[O:21])=[O:20])=[CH:23][CH:24]=1)([CH3:31])([CH3:29])[CH3:30]
参加物実験手順後処理出典と根拠反応ノート

参加物

3

反応物 2

HCID 14923Ammonium HydroxideHCID 25134745HCID 25134745、化合物

生成物 1

HCID 251349861-[2-(4-tert-butyl-benzenesulfonylamino)-5-chloro-phenyl]-1H-pyrazole-4-carboxylic acid amide

実験手順

1-[2-(4-tert-butyl-benzenesulfonylamino)-5-chloro-phenyl]-1H-pyrazole-4-carboxylic acid ethyl ester (synthesized according to general procedure D, 55 mg, 0.119 mmol) and 1 mL of ammonium hydroxide were stirred at 70° C. for 18 hours. The resultant solution was partitioned between saturated sodium bicarbonate and dichloromethane, and the aqueous layer extracted with dichloromethane. The combined organic layers were dried over magnesium sulfate, filtered, and concentrated in vacuo. The crude product was subsequently purified by flash column chromatography (0-100% ethyl acetate in hexanes) to yield 1-[2-(4-tert-butyl-benzenesulfonylamino)-5-chloro-phenyl]-1H-pyrazole-4-carboxylic acid amide: MS (ES) M+H expected 433.1, found 433.0.

後処理

  • customThe resultant solution was partitioned between saturated sodium bicarbonate and dichloromethane
  • extractionthe aqueous layer extracted with dichloromethane
  • dry with materialThe combined organic layers were dried over magnesium sulfate
  • filtrationfiltered
  • concentrationconcentrated in vacuo
  • customThe crude product was subsequently purified by flash column chromatography (0-100% ethyl acetate in hexanes)
  • 出典と根拠

    ORDレコード
    ord-505cfbf7334d4ac899f253ed0f348eb1
    出典データセット
    uspto-grants-2010_08
    DOI
    10.6084/m9.figshare.5104873.v1
    特許番号
    US07776877B2

    反応ノート

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