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Benzenesulfonyl chloride → 1-Benzenesulfonyl-3-iodo-5-morpholin-4-yl-1H-pyrrolo[2,3-b]pyridine

HRID 2114070
ノート
印刷プレビュー

反応式

HRID 2114070 の反応式
[C:1]1([S:7](Cl)(=[O:9])=[O:8])[CH:6]=[CH:5][CH:4]=[CH:3][CH:2]=1.[OH-].[Na+].[I:13][C:14]1[C:22]2[C:17](=[N:18][CH:19]=[C:20]([N:23]3[CH2:28][CH2:27][O:26][CH2:25][CH2:24]3)[CH:21]=2)[NH:16][CH:15]=1.C([O-])(O)=O.[Na+]>S([O-])(O)(=O)=O.C([N+](CCCC)(CCCC)CCCC)CCC.C(Cl)Cl.CO>[C:1]1([S:7]([N:16]2[C:17]3=[N:18][CH:19]=[C:20]([N:23]4[CH2:24][CH2:25][O:26][CH2:27][CH2:28]4)[CH:21]=[C:22]3[C:14]([I:13])=[CH:15]2)(=[O:9])=[O:8])[CH:6]=[CH:5][CH:4]=[CH:3][CH:2]=1
参加物実験手順後処理出典と根拠反応ノート

参加物

8

反応物 4

HCID 7369Benzenesulfonyl chlorideHCID 14798Sodium HydroxideHCID 516892Sodium BicarbonateHCID 598119141H-Pyrrolo[2,3-b]pyridine, 3-iodo-5-(4-morpholinyl)-

生成物 1

HCID 670515121-Benzenesulfonyl-3-iodo-5-morpholin-4-yl-1H-pyrrolo[2,3-b]pyridine収率 64.7%

試薬・触媒・溶媒 3

HCID 94433
Tetrabutylammonium hydrogen sulfate
触媒
HCID 887Methanol溶媒
HCID 6344Dichloromethane溶媒

実験手順

Tetrabutylammonium hydrogen sulfate (0.020 g, 0.059 mmol), benzenesulfonyl chloride (0.055 mL, 0.43 mmol) and 50% aqueous NaOH solution (0.20 mL) were added to a solution of 54 (0.095 g, 0.29 mmol) in CH2Cl2 (3 mL). After stirring for 2 hours, the mixture was poured into saturated aqueous NaHCO3 solution and extracted with CH2Cl2 three times. The combined organic solutions were washed with saturated aqueous NaHCO3 solution, dried (MgSO4), and concentrated to afford a tan syrup. MeOH was added to the syrup and the mixture was cooled in an ice bath. The precipitate was filtered off, washed with MeOH and dried to afford 55 (0.088 g) as a brown solid. The filtrate was concentrated and purified by means of preparative TLC with hexane:AcOEt as eluent to afford additional 55 (0.016 g, total yield: 0.104 g, 77%) as a brown solid. 1H NMR (400 MHz, CDCl3) δ 3.08-3.12 (m, 4H), 3.80-3.84 (m, 4H), 7.00 (d, J=0.26 Hz, 1H), 7.38-7.44 (m, 2H), 7.48-7.54 (m, 1H), 7.72 (s, 1H), 8.08-8.11 (m, 2H), 8.12 (d, J=0.26 Hz, 1H).

後処理

  1. extractionextracted with CH2Cl2 three times
  2. washThe combined organic solutions were washed with saturated aqueous NaHCO3 solution
  3. dry with materialdried (MgSO4)
  4. concentrationconcentrated
  5. customto afford a tan syrup
  6. temperaturethe mixture was cooled in an ice bath
  7. filtrationThe precipitate was filtered off
  8. washwashed with MeOH
  9. customdried

出典と根拠

ORDレコード
ord-9a80073952414e679c4e5ee9c0e04429
出典データセット
uspto-grants-2008_10
DOI
10.6084/m9.figshare.5104873.v1
特許番号
US07432375B2

反応ノート

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