Water → 1-[4-[2-(2-Fluoro-6-hydroxyphenyl)-7-methylquinazolin-4-yl]piperazin-1-yl]-2-hydroxy-4-methylpentan-1-one
Reaction equation
[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[Cl:1][c:2]1[n:3][c:4](-[c:13]2[c:14]([OH:20])[cH:15][cH:16][cH:17][c:18]2[F:19])[n:5][c:6]2[cH:7][c:8]([CH3:12])[cH:9][cH:10][c:11]12.[Cl:43][CH2:44][Cl:45].[OH2:21].[OH:22][CH:23]([C:24](=[O:25])[N:26]1[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]1)[CH2:32][CH:33]([CH3:34])[CH3:35]>>[c:2]1([N:29]2[CH2:28][CH2:27][N:26]([C:24]([CH:23]([OH:22])[CH2:32][CH:33]([CH3:34])[CH3:35])=[O:25])[CH2:31][CH2:30]2)[n:3][c:4](-[c:13]2[c:14]([OH:20])[cH:15][cH:16][cH:17][c:18]2[F:19])[n:5][c:6]2[cH:7][c:8]([CH3:12])[cH:9][cH:10][c:11]12Participants
6
Reactant 5
Product 1
Sources & evidence
- ORD record
- ord-fe67669df881467486af40e28e809123
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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