Formic Acid → Vandetanib

HRID 1238144Notes

Reaction equation

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

Participants

Reactant 3

HCID 284Formic Acid

HCID 712Formaldehyde

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

Product 1

HCID 3081361Vandetanib

Sources & evidence

ORD record: ord-496cd25a4de047c385a22c99d5660de0
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

Reaction notes

Loading…