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

Ethanol → 3-Benzoxazol-2-yl-5-[4-(dimethylaminomethyl)phenyl]pyridin-2-amine

HRID 1120718
노트
인쇄 미리보기

반응식

HRID 1120718 반응식
[CH3:24][N:25]([CH3:26])[CH2:27][c:28]1[cH:29][cH:30][c:31]([B:34]([OH:35])[OH:36])[cH:32][cH:33]1.[CH3:83][CH2:84][OH:85].[CH3:87][O:88][CH2:89][CH2:90][O:91][CH3:92].[Na+:1].[Na+:2].[O-:3][C:4](=[O:5])[O-:6].[O:37]=[CH:38][N:39]([CH3:40])[CH3:41].[OH2:86].[Pd:42]([Cl:43])[Cl:44].[c:45]1([P:46]([c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[cH:59][cH:60][cH:61][cH:62][cH:63]1.[c:64]1([P:65]([c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)[c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)[cH:78][cH:79][cH:80][cH:81][cH:82]1.[o:7]1[c:8](-[c:16]2[c:17]([NH2:23])[n:18][cH:19][c:20]([Br:22])[cH:21]2)[n:9][c:10]2[c:11]1[cH:12][cH:13][cH:14][cH:15]2>>[o:7]1[c:8](-[c:16]2[c:17]([NH2:23])[n:18][cH:19][c:20](-[c:31]3[cH:30][cH:29][c:28]([CH2:27][N:25]([CH3:24])[CH3:26])[cH:33][cH:32]3)[cH:21]2)[n:9][c:10]2[c:11]1[cH:12][cH:13][cH:14][cH:15]2
참가 물질출처 및 근거반응 노트

참가 물질

11

반응물 10

HCID 702EthanolHCID 923Sodium Ion2회HCID 962WaterHCID 6228DimethylformamideHCID 80711,2-DimethoxyethaneHCID 11776Triphenylphosphine2회HCID 19660Carbonate IonHCID 24290
Palladium Chloride
HCID 22506610{4-[(Dimethylamino)methyl]phenyl}boronic acid
HCID 673880093-(Benzoxazol-2-yl)-5-bromo-pyridin-2-amine

생성물 1

HCID 576871103-Benzoxazol-2-yl-5-[4-(dimethylaminomethyl)phenyl]pyridin-2-amine

출처 및 근거

ORD 기록
ord-5439d59a9c994938baf2a7aca07a5ae0
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

반응 노트

불러오는 중…

이 페이지에서참가 물질출처 및 근거반응 노트