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4-Methylmorpholine → N-(2-Acetylthiomethyl-4-phenylbutanoyl)-(L)-Leucine t-butyl ester

HRID 1780024
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HRID 1780024 반응식
[C:1]1([CH2:7][CH2:8][CH:9]([CH2:13][S:14][C:15](=[O:17])[CH3:16])[C:10]([OH:12])=O)[CH:6]=[CH:5][CH:4]=[CH:3][CH:2]=1.[NH2:18][C@H:19]([C:24]([O:26][C:27]([CH3:30])([CH3:29])[CH3:28])=[O:25])[CH2:20][CH:21]([CH3:23])[CH3:22].O.ON1C2C=CC=CC=2N=N1.CN1CCOCC1>C1COCC1.C(Cl)Cl>[C:27]([O:26][C:24](=[O:25])[C@H:19]([CH2:20][CH:21]([CH3:22])[CH3:23])[NH:18][C:10](=[O:12])[CH:9]([CH2:13][S:14][C:15](=[O:17])[CH3:16])[CH2:8][CH2:7][C:1]1[CH:2]=[CH:3][CH:4]=[CH:5][CH:6]=1)([CH3:30])([CH3:29])[CH3:28]
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참가 물질

7

반응물 4

HCID 79724-MethylmorpholineHCID 27960291-Hydroxybenzotriazole hydrateHCID 7022311tert-butyl (2S)-2-amino-4-methylpentanoateHCID 101062544-Phenyl-2-[acetylthio-methyl]butyric acid

생성물 1

HCID 54107687N-(2-Acetylthiomethyl-4-phenylbutanoyl)-(L)-Leucine t-butyl ester

시약·촉매·용매 2

HCID 6344
Dichloromethane
용매
HCID 8028Tetrahydrofuran용매

반응 조건

온도
0 °C

실험 절차

To a solution of 4-phenyl-2-[acetylthio-methyl]butyric acid (3.57 g. 14.2 mmole) in 66 mL of THF at 0° C. was added (S)-leucine, t-butyl ester (2.91 g 15.6 mmole) and 1-hydroxybenzotriazole hydrate (HOBT·H2O, 2.86 g, 21.2 mmole) and N-methylmorpholine (4.29 g, 42.4 mmole). The mixture was stirred at 0° C. for 15 minutes, then 5.42 g of 1-ethyl-3-(3-dimethyl-aminopropyl) carbodiimide hydrochloride (EDC·HCl, 28.3 mmole) was added and the mixture stirred overnight. The solution was worked up by adding 100 mL methylene chloride and the mixture extracted with 3×50 ml of 5% sodium bicarbonate and washed with 2×50 mL of brine. The organic layer was dried over MgSO4, filtered, and the solvent removed under reduced pressure. The residue was purified by flash column chromatography on silica gel eluted with methylene chloride/ethyl acetate (95/5).

후처리

  1. stirringthe mixture stirred overnight
  2. extractionthe mixture extracted with 3×50 ml of 5% sodium bicarbonate
  3. washwashed with 2×50 mL of brine
  4. dry with materialThe organic layer was dried over MgSO4
  5. filtrationfiltered
  6. customthe solvent removed under reduced pressure
  7. customThe residue was purified by flash column chromatography on silica gel
  8. washeluted with methylene chloride/ethyl acetate (95/5)

출처 및 근거

ORD 기록
ord-c953e933b815475aa54eb77e1304dbee
출처 데이터셋
uspto-grants-1997_05
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US05629343

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