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Potassium Carbonate → 2-Amino-5-[4-[3-(aminosulfonyl)phenyl]-6-quinolinyl]-3-pyridinesulfonamide

HRID 472070
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HRID 472070 반응식
Br[C:2]1[CH:3]=[C:4]2[C:9](=[CH:10][CH:11]=1)[N:8]=[CH:7][CH:6]=[C:5]2Cl.B1(B2OC(C)(C)C(C)(C)O2)OC(C)(C)C(C)(C)O1.C([O-])(=O)C.[K+].[NH2:36][C:37]1[C:42]([S:43]([NH2:46])(=[O:45])=[O:44])=[CH:41][C:40](Br)=[CH:39][N:38]=1.C(=O)([O-])[O-].[K+].[K+].CC1(C)C(C)(C)OB([C:62]2[CH:63]=[C:64]([S:68]([NH2:71])(=[O:70])=[O:69])[CH:65]=[CH:66][CH:67]=2)O1>O1CCOCC1.[Pd].C1C=CC([PH+]([C]2[CH][CH][CH][CH]2)C2C=CC=CC=2)=CC=1.C1C=CC([PH+]([C]2[CH][CH][CH][CH]2)C2C=CC=CC=2)=CC=1.C(Cl)Cl.Cl[Pd]Cl.[Fe]>[NH2:36][C:37]1[C:42]([S:43]([NH2:46])(=[O:45])=[O:44])=[CH:41][C:40]([C:2]2[CH:3]=[C:4]3[C:9](=[CH:10][CH:11]=2)[N:8]=[CH:7][CH:6]=[C:5]3[C:62]2[CH:67]=[CH:66][CH:65]=[C:64]([S:68]([NH2:71])(=[O:70])=[O:69])[CH:63]=2)=[CH:39][N:38]=1
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참가 물질

10

반응물 6

HCID 11430Potassium Carbonate2회HCID 517044Potassium AcetateHCID 2733548Bis(pinacolato)diboraneHCID 51395376-Bromo-4-chloroquinolineHCID 164142303-(Tetramethyl-1,3,2-dioxaborolan-2-yl)benzene-1-sulfonamideHCID 523351762-Amino-5-bromopyridine-3-sulfonamide

생성물 1

HCID 59860187
2-Amino-5-[4-[3-(aminosulfonyl)phenyl]-6-quinolinyl]-3-pyridinesulfonamide

시약·촉매·용매 3

HCID 23938Palladium촉매HCID 53485975CID 53485975촉매2회HCID 312751,4-Dioxane용매

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온도
100 °C

실험 절차

This compound was prepared in one pot (three steps) with no workups between steps. A mixture of 6-bromo-4-chloroquinoline, (484 mg, 2 mmol), bis(pinacolato)diboron, (506 mg, 2 mmol), dichloro-[1,1′bis(diphenylphosphino) ferrocene]palladium (II) dichloromethane adduct (81.5 mg, 0.1 mmol), and potassium acetate (588 mg, 6 mmol) in dioxane (6 mL) was heated at 100° C. for 4 h. To this reaction was added 2-amino-5-bromo-3-pyridinesulfonamide, (560 mg 2 mmol) an equal amount of the palladium catalyst used above (0.1 mmol) and 2 M potassium carbonate (3 mL). The reaction was heated at 95 deg centigrade for one hour. To this reaction was added 3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzenesulfonamide, (566 mg 2 mmol), dichloro-[1,1′bis(diphenylphosphino) ferrocene]palladium (II) dichloromethane adduct (81.5 mg, 0.1 mmol) and 2 M potassium carbonate (3 mL). The reaction was heated at 95° C. for three hours. The solvent was evaporated and the crude material purified by silica gel chromatography, eluting with ethyl acetate. The product was purified further by crystallizing from hot ethyl acetate. Obtained 181 mg (18.7%) for three steps. MS (ES)+ m/e 484 [M+H]+.

후처리

  1. customThis compound was prepared in one pot (three steps) with no workups between steps
  2. temperatureThe reaction was heated at 95 deg centigrade for one hour
  3. temperatureThe reaction was heated at 95° C. for three hours
  4. customThe solvent was evaporated
  5. customthe crude material purified by silica gel chromatography
  6. washeluting with ethyl acetate
  7. customThe product was purified further
  8. customby crystallizing from hot ethyl acetate
  9. customObtained 181 mg (18.7%) for three steps

출처 및 근거

ORD 기록
ord-1877679f6b4e43f686f49f92402f2f94
출처 데이터셋
uspto-grants-2014_01
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08633187B2

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