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Triethylamine hydrochloride → [4-(3-Hydroxypyrrolidinyl)-2-phenylbenzoyl]methionine methyl ester

HRID 325239
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Druckvorschau

Reaktionsgleichung

Reaktionsgleichung von HRID 325239
CO[C:3](=[O:18])[C:4]1[CH:9]=[CH:8][C:7](CCl)=[CH:6][C:5]=1[C:12]1[CH:17]=[CH:16][CH:15]=[CH:14][CH:13]=1.[NH:19]1[CH2:23][CH2:22][CH:21]([OH:24])[CH2:20]1.C([O-])([O-])=O.[K+].[K+].O[Li].O.Cl.[CH3:35][O:36][C:37](=[O:44])[C@H:38]([CH2:40][CH2:41][S:42][CH3:43])[NH2:39].ON1C(=O)C2C=CC=CC=2N=N1.CN(C)CCCN=C=NCC.Cl.C(N(CC)CC)C>[N+](CCCC)(CCCC)(CCCC)CCCC.[I-].CC#N.CO.C(OCC)(=O)C>[CH3:35][O:36][C:37](=[O:44])[C@H:38]([CH2:40][CH2:41][S:42][CH3:43])[NH:39][C:3](=[O:18])[C:4]1[CH:9]=[CH:8][C:7]([N:19]2[CH2:23][CH2:22][CH:21]([OH:24])[CH2:20]2)=[CH:6][C:5]=1[C:12]1[CH:13]=[CH:14][CH:15]=[CH:16][CH:17]=1
KomponentenVersuchsvorschriftAufarbeitungQuellen und NachweiseNotizen zur Reaktion

Komponenten

12

Edukt 8

HCID 11130Triethylamine hydrochlorideHCID 11430Potassium CarbonateHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 730263-hydroxy-1,2,3-benzotriazin-4(3H)-oneHCID 982104-HydroxypyrrolidineHCID 168937Lithium hydroxide, monohydrate
HCID 11435579
L-Methionine, methyl ester, hydrochloride
HCID 544945664-Chloromethyl-2-phenylbenzoic acid methyl ester

Produkt 1

HCID 70226038[4-(3-Hydroxypyrrolidinyl)-2-phenylbenzoyl]methionine methyl esterAusbeute 57,6 %

Reagenzien, Katalysatoren, Lösungsmittel 3

HCID 67553Tetrabutylammonium IodideKatalysatorHCID 6342AcetonitrileLösungsmittel2×HCID 21584119Ethylacetate methanolLösungsmittel

Versuchsvorschrift

A solution of 4-chloromethyl-2-phenylbenzoic acid methyl ester (0.521 g, 2.00 mmol), prepared as in Example 286A, 3-pyrrolidinol (0.178 g, 2.00 mmol), K2CO3 (0.553 g, 4.00 mmol), and Bu4NI (0.0754 g, 0.20 mmol) in CH3CN (5 mL) was stirred for 15 hours, treated with LiOH.H2O (0.506 g, 12.0 mmol), and then heated at reflux for 5 hours. The solution was cooled to ambient temperature and added to a mixture of L-methionine methyl ester hydrochloride (0.807 g, 4.00 mmol), 3-hydroxy-1,2,3-benzotriazin-4(3H)-one (1.66 g, 10.00 mmol), 1-(3-dimethylaminopropyl)-3-ethylcarbodiimide (1.96 g, 10.00 mmol), and triethylamine hydrochloride (2.81 g, 20 mmol) in CH3CN (15 mL). After 12 days the mixture was concentrated under reduced pressure and the residue was dissolved in ethyl acetate. The solution was extracted with a 1:1 mixture of H2O and saturated aqueous NaHCO3 (4×) and brine. The organic phase was dried (MgSO4) and concentrated to provide a gold oil. Radial chromatography (12% methanol-ethyl acetate) afforded the desired compound (0.494 g, 56%).

Aufarbeitung

  1. temperatureheated
  2. temperatureat reflux for 5 hours
  3. concentrationAfter 12 days the mixture was concentrated under reduced pressure
  4. dissolutionthe residue was dissolved in ethyl acetate
  5. extractionThe solution was extracted with a 1:1 mixture of H2O and saturated aqueous NaHCO3 (4×) and brine
  6. dry with materialThe organic phase was dried (MgSO4)
  7. concentrationconcentrated
  8. customto provide a gold oil

Quellen und Nachweise

ORD-Eintrag
ord-12062b0b96474b3db5312d55de694777
Quelldatensatz
uspto-grants-2001_04
DOI
10.6084/m9.figshare.5104873.v1
Patentnummer
US06221865B1

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