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Water → HCID 5276006, 화합물

HRID 1788529
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HRID 1788529 반응식
CO[C:3]([C:5]1[CH:38]=[CH:37][C:8]2[N:9]([CH:31]3[CH2:36][CH2:35][CH2:34][CH2:33][CH2:32]3)[C:10]([C:12]3[CH:13]=[C:14]4[C:19](=[CH:20][CH:21]=3)[N:18]=[C:17]([C:22]3[CH:27]=[C:26](OC)[CH:25]=[CH:24][C:23]=3Br)[CH:16]=[CH:15]4)=[N:11][C:7]=2[CH:6]=1)=[O:4].[C:39](=[O:42])(O)[O-].[Na+].[OH-:44].[K+].[OH2:46]>C1(C)C=CC=CC=1.CO.C1C=CC([P]([Pd]([P](C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=CC=2)([P](C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=CC=2)[P](C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=CC=2)(C2C=CC=CC=2)C2C=CC=CC=2)=CC=1>[C:10]([C:12]1[CH:13]=[CH:14][C:19]([C:23]2[C:22]([C:17]3[CH:16]=[CH:15][C:14]4[C:19](=[CH:20][CH:21]=[C:12]([C:10]5[N:9]([CH:31]6[CH2:32][CH2:33][CH2:34][CH2:35][CH2:36]6)[C:8]6[CH:37]=[CH:38][C:5]([C:3]([OH:4])=[O:46])=[CH:6][C:7]=6[N:11]=5)[CH:13]=4)[N:18]=3)=[CH:27][C:26]([O:42][CH3:39])=[CH:25][CH:24]=2)=[CH:20][CH:21]=1)(=[O:44])[NH2:9]
참가 물질반응 조건실험 절차후처리출처 및 근거반응 노트

참가 물질

8

반응물 4

HCID 962WaterHCID 14797Potassium HydroxideHCID 516892Sodium BicarbonateHCID 68922215HCID 68922215, 화합물

생성물 1

HCID 5276006HCID 5276006, 화합물

시약·촉매·용매 3

HCID 178418397HCID 178418397, 화합물
촉매
HCID 887Methanol용매2회
HCID 1140Toluene용매

반응 조건

온도
90 °C

실험 절차

In a flame dried vial with a Teflon lined screw cap, a solution of Compound 365b (100 mg, 0.175 mmol), 4-amidophenylboronic acid (31 mg, 0.2625 mmol), and Palladium Tetrakis (20 mg, 0.0175 mmol) in toluene (6.5 mL), methanol (1.6 mL), and saturated sodium bicarbonate in water (800 ul) was degassed, flushed with argon, and sealed. The reaction was stirred for 16 hours at 90° C. The vial was then cooled to room temperature and 10% w/v KOH in methanol (2 mL, 3.5 mmol) was added. The reaction was resealed and stirred at 70° C. for 1 hour. The completed reaction was then evaporated to dryness, purified via HPLC, and converted to the HCl salt using the standard procedure (as described for Compound 516) to produce the title compound.

후처리

  1. dry with materialIn a flame dried vial with a Teflon lined screw
  2. customcap
  3. customflushed with argon
  4. customsealed
  5. temperatureThe vial was then cooled to room temperature
  6. additionwas added
  7. stirringstirred at 70° C. for 1 hour
  8. customThe completed reaction
  9. customwas then evaporated to dryness
  10. custompurified via HPLC

출처 및 근거

ORD 기록
ord-147c10f1b8ef4deabab477614815e219
출처 데이터셋
uspto-grants-2009_03
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US07511145B2

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