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Tetrabutylammonium Fluoride → (2S)-2-(1-(2-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yloxy)-3-(3-hydroxyazetidin-1-yl)-N-(5-methylpyridin-2-yl)propanamide

HRID 1098052
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HRID 1098052 반응식
[F-].C([N+](CCCC)(CCCC)CCCC)CCC.[Si]([O:26][CH:27]1[CH2:30][N:29]([CH2:31][C@H:32]([O:43][C:44]2[N:49]=[CH:48][N:47]=[C:46]3[N:50]([C:53]4[CH:58]=[CH:57][CH:56]=[CH:55][C:54]=4[Cl:59])[N:51]=[CH:52][C:45]=23)[C:33]([NH:35][C:36]2[CH:41]=[CH:40][C:39]([CH3:42])=[CH:38][N:37]=2)=[O:34])[CH2:28]1)(C(C)(C)C)(C)C>C1COCC1>[Cl:59][C:54]1[CH:55]=[CH:56][CH:57]=[CH:58][C:53]=1[N:50]1[C:46]2=[N:47][CH:48]=[N:49][C:44]([O:43][C@@H:32]([CH2:31][N:29]3[CH2:28][CH:27]([OH:26])[CH2:30]3)[C:33]([NH:35][C:36]3[CH:41]=[CH:40][C:39]([CH3:42])=[CH:38][N:37]=3)=[O:34])=[C:45]2[CH:52]=[N:51]1
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참가 물질

4

반응물 2

HCID 2724141Tetrabutylammonium FluorideHCID 57504553(2S)-3-(3-(tert-butyldimethylsilyloxy)azetidin-1-yl)-2-(1-(2-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yloxy)-N-(5-methylpyridin-2-yl)propanamide

생성물 1

HCID 57504433(2S)-2-(1-(2-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yloxy)-3-(3-hydroxyazetidin-1-yl)-N-(5-methylpyridin-2-yl)propanamide

시약·촉매·용매 1

HCID 8028Tetrahydrofuran용매

실험 절차

Tetrabutylammonium fluoride (1M in THF) (1.515 mL, 1.51 mmol) was added to (2S)-3-(3-(tert-butyldimethylsilyloxy)azetidin-1-yl)-2-(1-(2-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yloxy)-N-(5-methylpyridin-2-yl)propanamide (Intermediate AD7) (0.9 g, 1.51 mmol) in THF (10 mL) under nitrogen. The resulting mixture was stirred at ambient temperature for 2.5 hours. The reaction mixture was quenched with saturated NH4Cl, diluted with DCM and poured onto a phase separator. The organic layer was evaporated to a gum. The crude product was purified by flash silica chromatography, elution gradient 0 to 10% MeOH in EtOAc to afford the product (0.313 g, 43.1%, 98% ee). 1H NMR (400 MHz, CDCl3) δ 2.29 (3H, s), 2.50-2.78 (1H, m), 3.15-3.31 (4H, m), 3.79-3.89 (2H, m), 4.47-4.55 (1H, m), 5.91 (1H, t), 7.42-7.56 (4H, m), 7.59-7.65 (1H, m), 8.08-8.14 (2H, m), 8.37 (1H, s), 8.59 (1H, s), 9.53 (1H, s); m/z (ES+) (M+H)+=480.41; HPLC tR=1.19 min.

후처리

  1. customThe reaction mixture was quenched with saturated NH4Cl
  2. additiondiluted with DCM
  3. additionpoured onto a phase separator
  4. customThe organic layer was evaporated to a gum
  5. customThe crude product was purified by flash silica chromatography, elution gradient 0 to 10% MeOH in EtOAc
  6. customto afford the product (0.313 g, 43.1%, 98% ee)

출처 및 근거

ORD 기록
ord-dad5cba79a9f4148976f307145a7eee7
출처 데이터셋
uspto-grants-2012_03
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08143263B2

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