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

Acetate → 1-[(4-Aminoquinazolin-7-yl)methyl]-4-[3-(6-methoxy-3-pyridinyl)prop-2-enyl]piperazin-2-one

HRID 672513
노트
인쇄 미리보기

반응식

HRID 672513 반응식
[CH3:20][O:21][c:22]1[cH:23][cH:24][c:25]([CH:28]=[CH:29][CH2:30][O:31][C:32](=[O:33])[CH3:34])[cH:26][n:27]1.[CH3:55][C:56]#[N:57].[CH3:67][CH2:68][N:69]([CH2:70][CH3:71])[CH2:72][CH3:73].[NH2:1][c:2]1[n:3][cH:4][n:5][c:6]2[cH:7][c:8]([CH2:12][N:13]3[C:14](=[O:19])[CH2:15][NH:16][CH2:17][CH2:18]3)[cH:9][cH:10][c:11]12.[O-:59][C:60]([CH3:61])=[O:62].[O-:63][C:64]([CH3:65])=[O:66].[OH2:54].[Pd+2:58].[c:35]1([P:36]([c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[cH:49][cH:50][cH:51][cH:52][cH:53]1>>[NH2:1][c:2]1[n:3][cH:4][n:5][c:6]2[cH:7][c:8]([CH2:12][N:13]3[C:14](=[O:19])[CH2:15][N:16]([CH2:30][CH:29]=[CH:28][c:25]4[cH:24][cH:23][c:22]([O:21][CH3:20])[n:27][cH:26]4)[CH2:17][CH2:18]3)[cH:9][cH:10][c:11]12
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 175Acetate2회HCID 962WaterHCID 6342AcetonitrileHCID 8471TriethylamineHCID 11776TriphenylphosphineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 179851741-(4-Aminoquinazoline-7-ylmethyl)piperazine-2-one
HCID 53935223
3-(6-Methoxy-3-pyridinyl)prop-2-enyl acetate

생성물 1

HCID 543205271-[(4-Aminoquinazolin-7-yl)methyl]-4-[3-(6-methoxy-3-pyridinyl)prop-2-enyl]piperazin-2-one

출처 및 근거

ORD 기록
ord-f50a4e89461545c5a8d6164063fdf27e
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

반응 노트

불러오는 중…

이 페이지에서참가 물질출처 및 근거반응 노트