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Potassium Iodide → HCID 18538919, Verbindung

HRID 412953
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Druckvorschau

Reaktionsgleichung

Reaktionsgleichung von HRID 412953
C(O[C:6]([N:8]1[CH2:13][CH2:12][CH:11]([S:14][C:15]2[S:16][C:17]3[CH:23]=[CH:22][CH:21]=[CH:20][C:18]=3[N:19]=2)[CH2:10][CH2:9]1)=O)(C)(C)C.FC(F)(F)C(O)=O.[C:31]([N:34]1[CH2:39][CH2:38][CH:37]([C:40]([N:42]([C:47]2[CH:52]=[CH:51][CH:50]=[C:49]([Cl:53])[CH:48]=2)[CH2:43][CH2:44]C[Cl:46])=[O:41])[CH2:36][CH2:35]1)(=[O:33])[CH3:32].C(=O)([O-])[O-].[K+].[K+].[I-].[K+]>ClCCl.C(OCC)(=O)C>[ClH:46].[C:31]([N:34]1[CH2:39][CH2:38][CH:37]([C:40]([N:42]([C:47]2[CH:52]=[CH:51][CH:50]=[C:49]([Cl:53])[CH:48]=2)[CH2:43][CH2:44][CH2:6][N:8]2[CH2:9][CH2:10][CH:11]([S:14][C:15]3[S:16][C:17]4[CH:23]=[CH:22][CH:21]=[CH:20][C:18]=4[N:19]=3)[CH2:12][CH2:13]2)=[O:41])[CH2:36][CH2:35]1)(=[O:33])[CH3:32]
KomponentenVersuchsvorschriftAufarbeitungQuellen und NachweiseNotizen zur Reaktion

Komponenten

8

Edukt 5

HCID 4875Potassium IodideHCID 6422Trifluoroacetic acidHCID 11430Potassium CarbonateHCID 18538476HCID 18538476, VerbindungHCID 18539076HCID 18539076, Verbindung

Produkt 1

HCID 18538919HCID 18538919, VerbindungAusbeute 34 %

Reagenzien, Katalysatoren, Lösungsmittel 2

HCID 6344DichloromethaneLösungsmittelHCID 8857Ethyl AcetateLösungsmittel

Versuchsvorschrift

To a solution of 1-tert-butoxycarbonyl-4-(2-benzothiazolylthio)piperidine (505 mg, 1.44 mmol) in dry dichloromethane (4 ml) was added trifluoroacetic acid (4 ml) and stirred at room temperature for 30 min. After the solvent was removed in vacuo, the residue was dissolved in methanol (4 ml) and evaporated. The residue was dissolved in dry acetonitrile (12 ml) followed by addition of 1-acetyl-N-(3-chlorophenyl)-N-(3-chloropropyl)-4-piperidinecarboxamide (400 mg, 1.12 mmol), potassium carbonate (0.77 g, 5.6 mmol), and potassium iodide (186 mg, 1.12 mmol). After stirred at 80° C. for 8 h, the mixture was diluted with ethyl acetate (60 ml), washed with brine (60 ml), dried over anhydrous magnesium sulfate, and evaporated. The residue was purified by preparative HPLC eluting water-acetonitrile containing 0.1% TFA. To the TFA salt was added 5% aqueous solution of potassium carbonate, extracted with ethyl acetate (30 ml), washed with brine, dried over anhydrous magnesium sulfate, and evaporated. The residue dissolved in ethyl acetate (20 ml) was treated with 4N hydrogen chloride in ethyl acetate (0.72 ml). After the solvent was removed in vacuo, the residue was washed with ether and dried in vacuo to give the title compound (230 mg, 34%) as a white solid.

Aufarbeitung

  1. customAfter the solvent was removed in vacuo
  2. dissolutionthe residue was dissolved in methanol (4 ml)
  3. customevaporated
  4. dissolutionThe residue was dissolved in dry acetonitrile (12 ml)
  5. stirringAfter stirred at 80° C. for 8 h
  6. washwashed with brine (60 ml)
  7. dry with materialdried over anhydrous magnesium sulfate
  8. customevaporated
  9. customThe residue was purified by preparative HPLC
  10. washeluting water-acetonitrile containing 0.1% TFA
  11. additionTo the TFA salt was added 5% aqueous solution of potassium carbonate
  12. extractionextracted with ethyl acetate (30 ml)
  13. washwashed with brine
  14. dry with materialdried over anhydrous magnesium sulfate
  15. customevaporated
  16. dissolutionThe residue dissolved in ethyl acetate (20 ml)
  17. additionwas treated with 4N hydrogen chloride in ethyl acetate (0.72 ml)
  18. customAfter the solvent was removed in vacuo
  19. washthe residue was washed with ether
  20. customdried in vacuo

Quellen und Nachweise

ORD-Eintrag
ord-852569b77be34b33bae8963d439e3583
Quelldatensatz
uspto-grants-2003_05
DOI
10.6084/m9.figshare.5104873.v1
Patentnummer
US06562978B1

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