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Tetrahydrofuran → (R)-methyl 2-(3-(cyclopropanecarboxamido)isoquinolin-7-yloxy)propanoate

HRID 1502283
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HRID 1502283 반응식
[OH:1][C:2]1[CH:11]=[C:10]2[C:5]([CH:6]=[C:7]([NH:12][C:13]([CH:15]3[CH2:17][CH2:16]3)=[O:14])[N:8]=[CH:9]2)=[CH:4][CH:3]=1.O1CCCC1.C[CH2:24][O:25][C:26]([C@@H:28](O)[CH3:29])=[O:27].C1(P(C2C=CC=CC=2)C2C=CC=CC=2)C=CC=CC=1.N(C(OCC)=O)=NC(OCC)=O>C(OCC)(=O)C>[CH:15]1([C:13]([NH:12][C:7]2[N:8]=[CH:9][C:10]3[C:5]([CH:6]=2)=[CH:4][CH:3]=[C:2]([O:1][C@H:28]([CH3:29])[C:26]([O:25][CH3:24])=[O:27])[CH:11]=3)=[O:14])[CH2:16][CH2:17]1
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참가 물질

7

반응물 5

HCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 92831(L)-ethyl lactate2회HCID 220568ethyl N-ethoxycarbonyliminocarbamate2회HCID 67975011N-(7-hydroxyisoquinolin-3-yl)cyclopropanecarboxamide

생성물 1

HCID 68095268(R)-methyl 2-(3-(cyclopropanecarboxamido)isoquinolin-7-yloxy)propanoate

시약·촉매·용매 1

HCID 8857Ethyl Acetate용매

실험 절차

To a solution of N-(7-hydroxyisoquinolin-3-yl)cyclopropanecarboxamide (68.7 mg, 0.301 mmol) in tetrahydrofuran (3.0 mL, 37 mmol) was added ethyl L-(-)-lactate (44 uL, 0.39 mmol) and triphenylphosphine (108.4 mg, 0.4133 mmol), followed by dropwise addition of diethyl azodicarboxylate (62 uL, 0.39 mmol). The resulting mixture was stirred at room temperature for 1 hour, and then ethyl L-(-)-lactate (13 uL, 0.11 mmol) and diethyl azodicarboxylate (19 uL, 0.12 mmol) were added. After an additional 2.5 hours, the reaction mixture was poured into ethyl acetate, washed with water and brine, dried over MgSO4, filtered, and evaporated in vacuo. The crude material was purified via flash chromatography on silica gel (12 g silica, solvent gradient: 0-80% ethyl acetate in heptanes) to provide a quantitative yield of (R)-methyl 2-(3-(cyclopropanecarboxamido)isoquinolin-7-yloxy)propanoate. LCMS (ESI): M+H=329.2.

후처리

  1. waitAfter an additional 2.5 hours
  2. washwashed with water and brine
  3. dry with materialdried over MgSO4
  4. filtrationfiltered
  5. customevaporated in vacuo
  6. customThe crude material was purified via flash chromatography on silica gel (12 g silica, solvent gradient: 0-80% ethyl acetate in heptanes)

출처 및 근거

ORD 기록
ord-8e2d91bd3fa14076a3aa79f86ffce776
출처 데이터셋
uspto-grants-2015_12
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US09206175B2

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