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Sulfuric Acid → 8-chloro-3-(3-methoxycarbonylbenzyl)quinazoline-2,4(1H,3H)-dione

HRID 927304
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Druckvorschau

Reaktionsgleichung

Reaktionsgleichung von HRID 927304
[Cl:1][C:2]1[CH:3]=[CH:4][CH:5]=[C:6]2[C:11]=1[NH:10][C:9](=[O:12])[NH:8][C:7]2=[O:13].C[Si](C)(C)N[Si](C)(C)C.S(=O)(=O)(O)O.Br[CH2:29][C:30]1[CH:31]=[C:32]([CH:37]=[CH:38][CH:39]=1)[C:33]([O:35][CH3:36])=[O:34]>C1(C)C=CC=CC=1.O1CCOCC1.CO.CN(C=O)C>[Cl:1][C:2]1[CH:3]=[CH:4][CH:5]=[C:6]2[C:11]=1[NH:10][C:9](=[O:12])[N:8]([CH2:29][C:30]1[CH:39]=[CH:38][CH:37]=[C:32]([C:33]([O:35][CH3:36])=[O:34])[CH:31]=1)[C:7]2=[O:13]
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Komponenten

9

Edukt 4

HCID 1118Sulfuric AcidHCID 13838Hexamethyldisilazane2×HCID 517981Methyl 3-(bromomethyl)benzoateHCID 196042968-Chloroquinazoline-2,4(1H,3H)-dione

Produkt 1

HCID 683891148-chloro-3-(3-methoxycarbonylbenzyl)quinazoline-2,4(1H,3H)-dioneAusbeute 29,1 %

Reagenzien, Katalysatoren, Lösungsmittel 4

HCID 887MethanolLösungsmittel
HCID 1140TolueneLösungsmittel
HCID 6228DimethylformamideLösungsmittel
HCID 312751,4-DioxaneLösungsmittel

Reaktionsbedingungen

Temperatur
160 °C

Versuchsvorschrift

To a suspension of 8-chloroquinazoline-2,4(1H,3H)-dione (5.1 g, 25.9 mmol) in toluene (50 mL) and hexamethyldisilazane (HMDS, 10.4 g, 64.9 mmol) was added sulfuric acid (0.25 g, 2.6 mmol). The mixture was heated to reflux and refluxed for 8 h until a clear solution was obtained. The solvent and excessive HMDS was removed via vacuum evaporation, and methyl 3-(bromomethyl)benzoate (5.9 g, 25.9 mmol) and DMF (1 mL) was added to the residue. The reaction mixture was heated to 160° C. and was stirred at this temperature for 3 h. It was diluted with 1,4-dioxane (6 mL) at 100° C., and then methanol (10 mL) was added at 70° C. and it was stirred for 30 min. The mixture was cooled to 5° C. and the precipitates were collected. The solids was washed with methanol (10 mL) and water (20 mL), dried under vacuum for 12 h to give the title compound 8-chloro-3-(3-methoxycarbonylbenzyl)quinazoline-2,4(1H,3H)-dione (2.6 g, 29.1% yield) as gray solid. MS: m/z 477.1 [M+H]+. The filtrate was concentrated, and the residue was purified by preparative TLC (PE:EA=1:1) to give the other title compound 8-chloro-1-(3-methoxycarbonylbenzyl)quinazoline-2,4(1H,3H)-dione (0.2 g, 1.8%) as yellow solid. MS: m/z 477.1 [M+H]+.

Aufarbeitung

  1. temperatureThe mixture was heated
  2. temperatureto reflux
  3. temperaturerefluxed for 8 h until a clear solution
  4. customwas obtained
  5. additionwas added to the residue
  6. stirringit was stirred for 30 min
  7. temperatureThe mixture was cooled to 5° C.
  8. customthe precipitates were collected
  9. washThe solids was washed with methanol (10 mL) and water (20 mL)
  10. customdried under vacuum for 12 h

Quellen und Nachweise

ORD-Eintrag
ord-b863474527394164932893d775e22de8
Quelldatensatz
uspto-grants-2016_03
DOI
10.6084/m9.figshare.5104873.v1
Patentnummer
US09290460B2

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