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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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Hydrochloric Acid → 2-{[(2R,6S)-2,6-Dimethyl-4-morpholinyl]methyl}-N-(6-{6-(methyloxy)-5-[(1H-pyrazol-4-ylsulfonyl)amino]-3-pyridinyl}-1H-indazol-4-yl)-1,3-thiazole-4-carboxamide

HRID 1695790
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HRID 1695790 반응식
[NH2:1][C:2]1[CH:3]=[C:4]([C:10]2[CH:18]=[C:17]3[C:13]([CH:14]=[N:15][N:16]3S(C3C=CC(C)=CC=3)(=O)=O)=[C:12]([NH:29][C:30]([C:32]3[N:33]=[C:34]([CH2:37][N:38]4[CH2:43][C@H:42]([CH3:44])[O:41][C@H:40]([CH3:45])[CH2:39]4)[S:35][CH:36]=3)=[O:31])[CH:11]=2)[CH:5]=[N:6][C:7]=1[O:8][CH3:9].[NH:46]1[CH:50]=[C:49]([S:51](Cl)(=[O:53])=[O:52])[CH:48]=[N:47]1.Cl.C(Cl)Cl>N1C=CC=CC=1>[CH3:45][C@H:40]1[O:41][C@@H:42]([CH3:44])[CH2:43][N:38]([CH2:37][C:34]2[S:35][CH:36]=[C:32]([C:30]([NH:29][C:12]3[CH:11]=[C:10]([C:4]4[CH:5]=[N:6][C:7]([O:8][CH3:9])=[C:2]([NH:1][S:51]([C:49]5[CH:50]=[N:46][NH:47][CH:48]=5)(=[O:53])=[O:52])[CH:3]=4)[CH:18]=[C:17]4[C:13]=3[CH:14]=[N:15][NH:16]4)=[O:31])[N:33]=2)[CH2:39]1
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참가 물질

6

반응물 4

HCID 313Hydrochloric AcidHCID 6344DichloromethaneHCID 227331271H-pyrazole-4-sulfonyl chlorideHCID 58255776N-{6-[5-Amino-6-(methyloxy)-3-pyridinyl]-1-[(4-methylphenyl)sulfonyl]-1H-indazol-4-yl}-2-{[(2R,6S)-2,6-dimethyl-4-morpholinyl]methyl}-1,3-thiazole-4-carboxamide

생성물 1

HCID 67155653
2-{[(2R,6S)-2,6-Dimethyl-4-morpholinyl]methyl}-N-(6-{6-(methyloxy)-5-[(1H-pyrazol-4-ylsulfonyl)amino]-3-pyridinyl}-1H-indazol-4-yl)-1,3-thiazole-4-carboxamide

시약·촉매·용매 1

HCID 1049Pyridine용매

실험 절차

N-{6-[5-Amino-6-(methyloxy)-3-pyridinyl]-1-[(4-methylphenyl)sulfonyl]-1H-indazol-4-yl}-2-{[(2R,6S)-2,6-dimethyl-4-morpholinyl]methyl}-1,3-thiazole-4-carboxamide (65 mg) was dissolved in pyridine (2 ml) and 1H-pyrazole-4-sulfonyl chloride (25 mg) was added. The reaction was stirred at RT overnight. 2M HCl (aq) (12 ml) and DCM (12 ml) were added and the reaction was vigorously stirred. The solvent was passed through a hydrophobic frit then removed under nitrogen blow down. IPA (2 ml) and 2M NaOH (aq) (1 ml) were added and the reaction was stirred at RT. The reaction was evaporated to dryness and water (1 ml) and DCM (3 ml) were added, followed by 2M HCl (aq) (1 ml). A precipitate was observed. The mixture was evaporated to dryness. The residue was purified by MDAP using the following method:

후처리

  1. stirringthe reaction was vigorously stirred
  2. customthen removed under nitrogen blow down
  3. additionIPA (2 ml) and 2M NaOH (aq) (1 ml) were added
  4. stirringthe reaction was stirred at RT
  5. customThe reaction was evaporated to dryness and water (1 ml) and DCM (3 ml)
  6. additionwere added
  7. customThe mixture was evaporated to dryness
  8. customThe residue was purified by MDAP

출처 및 근거

ORD 기록
ord-7c422b277f0344b98fc02112de3d2a3a
출처 데이터셋
uspto-grants-2012_04
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08163743B2

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