Potassium Cation → 1-(4-(2-hydroxy-2-methylpropoxy)-3-methoxyphenyl)-4-(4-(trifluoromethoxy)-phenyl)pyridin-2(1H)-one

HRID 179248

Reaction equation

HRID 179248 reaction equation
[Cl:1][c:2]1[cH:3][c:4](=[O:22])[n:5](-[c:8]2[cH:9][c:10]([O:20][CH3:21])[c:11]([O:14][CH2:15][C:16]([CH3:17])([CH3:18])[OH:19])[cH:12][cH:13]2)[cH:6][cH:7]1.[Cl:50][CH2:51][Cl:52].[F:23][C:24]([O:25][c:26]1[cH:27][cH:28][c:29]([B:32]([OH:33])[OH:34])[cH:30][cH:31]1)([F:35])[F:36].[K+:42].[K+:43].[K+:44].[O:45]=[CH:46][N:47]([CH3:48])[CH3:49].[P:37]([O-:38])([O-:39])([O-:40])=[O:41]>>[c:2]1(-[c:29]2[cH:28][cH:27][c:26]([O:25][C:24]([F:23])([F:35])[F:36])[cH:31][cH:30]2)[cH:3][c:4](=[O:22])[n:5](-[c:8]2[cH:9][c:10]([O:20][CH3:21])[c:11]([O:14][CH2:15][C:16]([CH3:17])([CH3:18])[OH:19])[cH:12][cH:13]2)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 813Potassium Cation3×HCID 1061PhosphateHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 27343864-(Trifluoromethoxy)phenylboronic acidHCID 585802944-chloro-1-(4-(2-hydroxy-2-methylpropoxy)-3-methoxyphenyl)pyridin-2(1H)-one

Product 1

HCID 469111461-(4-(2-hydroxy-2-methylpropoxy)-3-methoxyphenyl)-4-(4-(trifluoromethoxy)-phenyl)pyridin-2(1H)-one

Sources & evidence

ORD record
ord-20799b7d0ed54745bed2f7a1fafcf450
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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