홈MCP워크벤치Skills
홈워크벤치알림마이페이지
llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
  1. 홈
  2. /반응

Tetrahydrofuran → HCID 86758813, 화합물

HRID 1635926
노트
인쇄 미리보기

반응식

HRID 1635926 반응식
[N+:1](C1C=CC=CC=1CC(O)=O)([O-:3])=[O:2].C(N1C=CN=C1)(N1C=CN=C1)=O.[NH2:26][C:27]1[C:31]([C:32]2[CH:37]=[CH:36][N:35]=[CH:34][CH:33]=2)=[C:30]([C:38]2[CH:43]=[CH:42][C:41]([F:44])=[CH:40][CH:39]=2)[NH:29][N:28]=1.[CH2:45]1CCN2[C:48](=NCCC2)[CH2:47][CH2:46]1.[O:56]1[CH2:60][CH2:59][CH2:58][CH2:57]1>>[F:44][C:41]1[CH:42]=[CH:43][C:38]([C:30]2[NH:29][N:28]=[C:27]([NH:26][C:60](=[O:56])[CH:59]([C:58]3[CH:48]=[CH:47][CH:46]=[CH:45][CH:57]=3)[N+:1]([O-:3])=[O:2])[C:31]=2[C:32]2[CH:37]=[CH:36][N:35]=[CH:34][CH:33]=2)=[CH:39][CH:40]=1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 8028TetrahydrofuranHCID 682631,1'-CarbonyldiimidazoleHCID 77337(2-Nitrophenyl)acetic acidHCID 811841,8-Diazabicyclo(5.4.0)undec-7-eneHCID 155131013-Amino-5-(4-fluorophenyl)-4-(4-pyridyl)pyrazole

생성물 1

HCID 86758813HCID 86758813, 화합물수율 14%

실험 절차

Under a stream of argon gas, 543 mg of 2-nitrophenylacetic acid and 486 mg of carbonyldiimidazole were dissolved in 10 ml of tetrahydrofuran, followed by stirring at room temperature for 10 minutes. Then, 254 mg of 3-amino-5-(4-fluorophenyl)-4-(4-pyridyl)pyrazole and 457 mg of DBU were added thereto, followed by stirring at room temperature overnight. After the reaction mixture was concentrated under reduced pressure, the resulting residue was suspended in chloroform, washed with a saturated aqueous solution of sodium bicarbonate and a saturated aqueous solution of sodium chloride, dried over anhydrous magnesium sulfate, and then concentrated. The resulting residue was purified by column chromatography using 40 g of silica gel [with an elution solvent comprising chloroform-methanol (100:1)]. Thus, 70 mg (14% yield) of the title compound was obtained as a white powder.

후처리

  1. stirringby stirring at room temperature overnight
  2. concentrationAfter the reaction mixture was concentrated under reduced pressure
  3. washwashed with a saturated aqueous solution of sodium bicarbonate
  4. dry with materiala saturated aqueous solution of sodium chloride, dried over anhydrous magnesium sulfate
  5. concentrationconcentrated
  6. customThe resulting residue was purified by column chromatography

출처 및 근거

ORD 기록
ord-cc06a8f82a774264a211d7527115512d
출처 데이터셋
uspto-grants-2003_01
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US06511997B1

반응 노트

불러오는 중…

이 페이지에서참가 물질실험 절차후처리출처 및 근거반응 노트