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

Piperidine → 5-{2-[(5-chloro-1H-indol-3-yl)methyl]-7-isobutyl-5-methyl-4,6-dioxo-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-d]pyrimidin-3-yl}-1-methyl-1H-pyrrole-3-carbonitrile

HRID 1181676
노트
인쇄 미리보기

반응식

HRID 1181676 반응식
[CH:1]([C:3]1[N:7]([CH3:8])[CH:6]=[C:5]([C:9]#[N:10])[CH:4]=1)=O.N1CCCCC1.[CH2:17]([N:21]1[C:26]([NH:27][N:28]=[CH:29][C:30]2[C:38]3[C:33](=[CH:34][CH:35]=[C:36]([Cl:39])[CH:37]=3)[NH:32][CH:31]=2)=[CH:25][C:24](=[O:40])[N:23]([CH3:41])[C:22]1=[O:42])[CH:18]([CH3:20])[CH3:19]>CN(C)C=O>[Cl:39][C:36]1[CH:37]=[C:38]2[C:33](=[CH:34][CH:35]=1)[NH:32][CH:31]=[C:30]2[CH2:29][N:28]1[C:1]([C:3]2[N:7]([CH3:8])[CH:6]=[C:5]([C:9]#[N:10])[CH:4]=2)=[C:25]2[C:26]([N:21]([CH2:17][CH:18]([CH3:20])[CH3:19])[C:22](=[O:42])[N:23]([CH3:41])[C:24]2=[O:40])=[N:27]1
참가 물질반응 조건실험 절차후처리출처 및 근거반응 노트

참가 물질

5

반응물 3

HCID 8082PiperidineHCID 127304775-formyl-1-methyl-1H-pyrrole-3-carbonitrileHCID 1363341125-chloro-1H-indole-3-carbaldehyde (3-isobutyl-1-methyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)hydrazone

생성물 1

HCID 589810345-{2-[(5-chloro-1H-indol-3-yl)methyl]-7-isobutyl-5-methyl-4,6-dioxo-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-d]pyrimidin-3-yl}-1-methyl-1H-pyrrole-3-carbonitrile수율 59%

시약·촉매·용매 1

HCID 6228Dimethylformamide용매

반응 조건

온도
50 °C

실험 절차

5-formyl-1-methyl-1H-pyrrole-3-carbonitrile (0.032 g) and piperidine (0.05 ml) was added to a solution of 5-chloro-1H-indole-3-carbaldehyde (3-isobutyl-1-methyl-2,6-dioxo-1,2,3,6-tetrahydropyrimidin-4-yl)hydrazone (0.075 g) in dimethylformamide (1.5 ml). The solution was heated at 50° C. for 5 hours. Reaction cooled to room temperature and purified on preparative HPLC to give the title compound (0.058 g). Mass: 490.16 (M+H).

후처리

  1. customReaction
  2. temperaturecooled to room temperature
  3. custompurified on preparative HPLC

출처 및 근거

ORD 기록
ord-8a05b58e3ffa4b32bc0d11c376aa26e7
출처 데이터셋
uspto-grants-2007_10
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US07285558B2

반응 노트

불러오는 중…

이 페이지에서참가 물질반응 조건실험 절차후처리출처 및 근거반응 노트