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Benzyl isocyanate → Methyl 3-[5-(3-{[benzylamino]carbonylamino}propoxy)indolyl]propanoate

HRID 1295124
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HRID 1295124 반응식
[NH2:1][CH2:2][CH2:3][CH2:4][O:5][C:6]1[CH:7]=[C:8]2[C:12](=[CH:13][CH:14]=1)[NH:11][C:10]([CH2:15][CH2:16][C:17]([O:19][CH3:20])=[O:18])=[CH:9]2.[CH2:21]([N:28]=[C:29]=[O:30])[C:22]1[CH:27]=[CH:26][CH:25]=[CH:24][CH:23]=1>C(#N)C>[CH2:21]([NH:28][C:29]([NH:1][CH2:2][CH2:3][CH2:4][O:5][C:6]1[CH:7]=[C:8]2[C:12](=[CH:13][CH:14]=1)[NH:11][C:10]([CH2:15][CH2:16][C:17]([O:19][CH3:20])=[O:18])=[CH:9]2)=[O:30])[C:22]1[CH:27]=[CH:26][CH:25]=[CH:24][CH:23]=1
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참가 물질

4

반응물 2

HCID 76639Benzyl isocyanateHCID 66819503Methyl 3-[5-(aminopropoxy)indolyl]propanoate

생성물 1

HCID 22570288Methyl 3-[5-(3-{[benzylamino]carbonylamino}propoxy)indolyl]propanoate수율 42%

시약·촉매·용매 1

HCID 6342Acetonitrile용매

실험 절차

To the solution of methyl 3-[5-(aminopropoxy)indolyl]propanoate (140 mg, 0.5 mmol), as prepared in the preceding step, in acetonitrile (10 mL) was added benzyl isocynate (135 mg, 1.0 mmol), and the mixture was stirred at ambient temperature overnight. After evaporating the solvent in vacuo, the residue was purified by flash column chromatography on silica gel (methylene chloride to 5% ethyl acetate in methylene chloride) to give the title compound as a white solid (85 mg, 42%). 1H-NMR (400 MHz, CDCl3) δ 7.28 (m, 5H), 7.20 (d, J=8.9 Hz, 1H), 7.10 (d, J=2.8 Hz, 1H), 7.05 (d, J=2.5 Hz, 1H), 6.81 (dd, J=8.8, 2.5 Hz, 1H), 6.38 (d, J=2.9 Hz, 1H), 4.66 (br s, 2H), 4.41 (t, J=6.8 Hz, 2H), 4.35 (d, J=5.7 Hz, 2H), 4.06 (t, J=5.8 Hz, 2H), 3.66 (s, 3H), 3.43 (q, J=6.2 Hz, 2H), 2.81 (t, J=6.8 Hz, 2H), 1.99 (t, J=6.1, 2H).

후처리

  1. customAfter evaporating the solvent in vacuo
  2. customthe residue was purified by flash column chromatography on silica gel (methylene chloride to 5% ethyl acetate in methylene chloride)

출처 및 근거

ORD 기록
ord-0a92c1b6a47e4646a261644076c3fc84
출처 데이터셋
uspto-grants-2007_07
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US07241789B2

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