Dichloromethane → N-Desmethyl vandetanib

HRID 806424

반응식

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

참가 물질

반응물 3

HCID 6344Dichloromethane

HCID 6422Trifluoroacetic acid

HCID 11049999tert-Butyl 4-(((4-((4-bromo-2-fluorophenyl)amino)-6-methoxyquinazolin-7-yl)oxy)methyl)piperidine-1-carboxylate

생성물 1

HCID 5329048N-Desmethyl vandetanib

출처 및 근거

ORD 기록: ord-660c98fad5274dcab0d3c2b61028cf17
출처 데이터셋: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D

연결된 노트

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