Dimethylformamide → N-[(4-chlorophenyl)methyl]-6-[[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-methyl-amino]methyl]-1-methyl-4-oxo-quinoline-3-carboxamide

HRID 123803

반응식

HRID 123803 반응식
[CH3:35][NH:36][CH2:37][CH:38]([OH:39])[c:40]1[cH:41][cH:42][c:43]([OH:44])[cH:45][cH:46]1.[CH:26]([N:27]([CH:28]([CH3:29])[CH3:30])[CH2:31][CH3:32])([CH3:33])[CH3:34].[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH:7][C:8](=[O:9])[c:10]2[cH:11][n:12]([CH3:23])[c:13]3[cH:14][cH:15][c:16]([CH2:21][Cl:22])[cH:17][c:18]3[c:19]2=[O:20])[cH:24][cH:25]1.[Cl:52][CH2:53][Cl:54].[O:47]=[CH:48][N:49]([CH3:50])[CH3:51]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:6][NH:7][C:8](=[O:9])[c:10]2[cH:11][n:12]([CH3:23])[c:13]3[cH:14][cH:15][c:16]([CH2:21][N:36]([CH3:35])[CH2:37][CH:38]([OH:39])[c:40]4[cH:41][cH:42][c:43]([OH:44])[cH:45][cH:46]4)[cH:17][c:18]3[c:19]2=[O:20])[cH:24][cH:25]1

참가 물질

6

반응물 5

HCID 6228DimethylformamideHCID 6344DichloromethaneHCID 7172SynephrineHCID 81531DiisopropylethylamineHCID 21192571N-(4-Chlorobenzyl)-6-(chloromethyl)-1-methyl-4-oxo-1,4-dihydro-3-quinolinecarboxamide

생성물 1

HCID 9849068N-[(4-chlorophenyl)methyl]-6-[[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]-methyl-amino]methyl]-1-methyl-4-oxo-quinoline-3-carboxamide

출처 및 근거

ORD 기록
ord-425f43d678334f70bb6bde42a0a4440c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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