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3-Pyrroline → HCID 178521018, 화합물

HRID 931315
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HRID 931315 반응식
[NH:1]1[CH2:5][CH:4]=[CH:3][CH2:2]1.[Cl:6][C:7]1[CH:8]=[N:9][N:10]([C:12]2([C:15]3[NH:32][C:18]4=[N:19][C:20]([N:23]5[CH2:28][CH2:27][CH2:26][C@@H:25]([C:29](O)=[O:30])[CH2:24]5)=[CH:21][CH:22]=[C:17]4[N:16]=3)[CH2:14][CH2:13]2)[CH:11]=1.F[P-](F)(F)(F)(F)F.N1(OC(N(C)C)=[N+](C)C)C2N=CC=CC=2N=N1.C(N(C(C)C)CC)(C)C>ClCCl>[Cl:6][C:7]1[CH:8]=[N:9][N:10]([C:12]2([C:15]3[NH:32][C:18]4=[N:19][C:20]([N:23]5[CH2:28][CH2:27][CH2:26][C@@H:25]([C:29]([N:1]6[CH2:5][CH:4]=[CH:3][CH2:2]6)=[O:30])[CH2:24]5)=[CH:21][CH:22]=[C:17]4[N:16]=3)[CH2:14][CH2:13]2)[CH:11]=1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

6

반응물 4

HCID 660593-PyrrolineHCID 81531DiisopropylethylamineHCID 9886157Methanaminium, N-((dimethylamino)(3H-1,2,3-triazolo(4,5-b)pyridin-3-yloxy)methylene)-N-methyl-, hexafluorophosphate(1-) (1:1)HCID 178525787HCID 178525787, 화합물

생성물 1

HCID 178521018HCID 178521018, 화합물수율 90.3%

시약·촉매·용매 1

HCID 6344Dichloromethane용매

실험 절차

3-Pyrroline (98.5 mg, 1.41 mmol) was added to a solution of (R)-1-(2-(1-(4-chloro-1H-pyrazol-1-yl)cyclopropyl)-3H-imidazo[4,5-b]pyridin-5-yl)piperidine-3-carboxylic acid (500 mg, 1.29 mmol), O-(7-azabenzotriazol-1-yl)-N,N,N′,N′,-tetramethyluronium hexafluorophosphate (HATU) (541 mg, 1.41 mmol) and diisopropylethylamine (334.7 mg, 2.58 mmol) in anhydrous dichloromethane (20 mL). The reaction mixture was stirred at room temperature for 2 h. The mixture was partitioned between dichloromethane and water. The organic layer was dried over sodium sulfate and concentrated under reduced pressure. The crude material was triturated with pentane to afford the title compound (510 mg). MS (ES+) (M+H) 438.0; LCMS retention time 4.935 min (Method R1).

후처리

  1. customThe mixture was partitioned between dichloromethane and water
  2. dry with materialThe organic layer was dried over sodium sulfate
  3. concentrationconcentrated under reduced pressure
  4. customThe crude material was triturated with pentane

출처 및 근거

ORD 기록
ord-733c2ace24d04d0f8bf79a2276aa8299
출처 데이터셋
uspto-grants-2016_03
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US09296745B2

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