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Diisopropylethylamine → [4-({[2-(Benzo[1,3]dioxol-5-yloxy)-pyridine-3-carbonyl]-amino}-methyl)-phenyl]-acetic acid methyl ester

HRID 1297582
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HRID 1297582 반응식
Cl.CN(C)CCCN=C=NCC.O.ON1C2C=CC=CC=2N=N1.[O:24]1[C:28]2[CH:29]=[CH:30][C:31]([O:33][C:34]3[N:42]=[CH:41][CH:40]=[CH:39][C:35]=3[C:36]([OH:38])=O)=[CH:32][C:27]=2[O:26][CH2:25]1.C(N(CC)C(C)C)(C)C.[CH3:52][O:53][C:54](=[O:64])[CH2:55][C:56]1[CH:61]=[CH:60][C:59]([CH2:62][NH2:63])=[CH:58][CH:57]=1>ClCCl.O>[CH3:52][O:53][C:54](=[O:64])[CH2:55][C:56]1[CH:61]=[CH:60][C:59]([CH2:62][NH:63][C:36]([C:35]2[C:34]([O:33][C:31]3[CH:30]=[CH:29][C:28]4[O:24][CH2:25][O:26][C:27]=4[CH:32]=3)=[N:42][CH:41]=[CH:40][CH:39]=2)=[O:38])=[CH:58][CH:57]=1
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참가 물질

8

반응물 5

HCID 81531DiisopropylethylamineHCID 1514145Methyl 4-aminomethylphenylacetateHCID 27239391,3-Propanediamine, N'-(ethylcarbonimidoyl)-N,N-dimethyl-, monohydrochlorideHCID 27368792-(1,3-Benzodioxol-5-yloxy)pyridine-3-carboxylic acidHCID 27960291-Hydroxybenzotriazole hydrate

생성물 1

HCID 10202284
[4-({[2-(Benzo[1,3]dioxol-5-yloxy)-pyridine-3-carbonyl]-amino}-methyl)-phenyl]-acetic acid methyl ester

시약·촉매·용매 2

HCID 962Water용매HCID 6344Dichloromethane용매

실험 절차

1-[3-(Dimethylamino)propyl]-3-ethylcarbodiimide hydrochloride (1.71 g), 1-hydoxybenzo-triazole hydrate (1.24 g), and 2-(benzo[1,3]dioxol-5-yloxy)-nicotinic acid were combined and suspended in anhydrous dichloromethane (40 mL). N,N-diisopropylethylamine (5.93 mL) was added to the suspension, which was stirred for 0.5 h. The suspension was added to (4-aminomethyl-phenyl)-acetic acid methyl ester (1.22 g) and the reaction mixture stirred at ambient temperature overnight. Water (approx. 15 mL) was then added to the reaction mixture, and it was extracted with dichloromethane (7×30 mL). The combined organics were dried over magnesium sulfate, filtered, and concentrated in vacuo. The crude product was purified by silica gel chromatography (ethyl acetate:hexanes=3:2) to yield the title compound (1.41 g).

후처리

  1. stirringthe reaction mixture stirred at ambient temperature overnight
  2. extractionwas extracted with dichloromethane (7×30 mL)
  3. dry with materialThe combined organics were dried over magnesium sulfate
  4. filtrationfiltered
  5. concentrationconcentrated in vacuo
  6. customThe crude product was purified by silica gel chromatography (ethyl acetate:hexanes=3:2)

출처 및 근거

ORD 기록
ord-2fb9f61ea113439fbf08775257eedea3
출처 데이터셋
uspto-grants-2007_07
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US07250518B2

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