Methanol → 3-(hydroxymethyl)-6a,7,9,10-tetrahydropyrido[3,2-e][1,4]thiazino[4,3-a]pyrazin-6(5H)-one

HRID 69655

반응식

HRID 69655 반응식
[O:1]=[C:2]1[NH:7][C:6]2[CH:8]=[C:9]([C:12](OC)=[O:13])[CH:10]=[N:11][C:5]=2[N:4]2[CH2:16][CH2:17][S:18][CH2:19][CH:3]12.[H-].[Na+].[H-].[Al+3].[Li+].[H-].[H-].[H-].CO>O1CCCC1.O.C(OCC)(=O)C>[OH:13][CH2:12][C:9]1[CH:10]=[N:11][C:5]2[N:4]3[CH2:16][CH2:17][S:18][CH2:19][CH:3]3[C:2](=[O:1])[NH:7][C:6]=2[CH:8]=1

참가 물질

8

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온도
-78 °C

실험 절차

Methyl 6-oxo-5,6,6a,7,9,10-hexahydropyrido[3,2-e][1,4]thiazino[4,3-a]pyrazine-3-carboxylate (386 mg, 1.38 mmol) was taken up in tetrahydrofuran (25 mL) in an inert environment. To the stirred suspension at room temperature was added NaH (60% dispersion in mineral oil, 121 mg, 3.03 mmol) and stirred 30 min. The reaction was cooled to −78° C. and lithium aluminum hydride (3 mL, 2M in THF) was added. The reaction was stirred at a temperature between −20 and −10° C. for 3 h. The reaction was cooled back to −78° C. and MeOH (1 mL) followed by water (1 mL) was added. The reaction was allowed to stir at ambient temperature for 2 h and then poured into ethyl acetate (200 mL) and water (100 mL). The biphasic mixture was stirred vigorously and then filtered through a medium frit. The layers were separated and the aqueous phase was extracted with ethyl acetate (2×50 mL). The organic layers were combined, washed with brine (100 mL), dried with sodium sulfate and concentrated to afford the title compound (497 mg, 98%) as a white solid. [M+H] calc'd for C11H13N3O2S, 252; found, 252.

후처리

  1. stirringThe reaction was stirred at a temperature between −20 and −10° C. for 3 h
  2. temperatureThe reaction was cooled back to −78° C.
  3. additionwas added
  4. stirringto stir at ambient temperature for 2 h
  5. stirringThe biphasic mixture was stirred vigorously
  6. filtrationfiltered through a medium frit
  7. customThe layers were separated
  8. extractionthe aqueous phase was extracted with ethyl acetate (2×50 mL)
  9. washwashed with brine (100 mL)
  10. dry with materialdried with sodium sulfate
  11. concentrationconcentrated

출처 및 근거

ORD 기록
ord-b2550ae36288472fab41911a31ba5d50
출처 데이터셋
uspto-grants-2014_09
특허 번호
US08822470B2

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