Potassium Cation → 8-(4-chlorophenyl)-7-p-tolyl-2-((6-(trifluoromethyl)pyridin-3-yl)methyl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one

HRID 183340Notes

Reaction equation

HRID 183340 reaction equation
[CH2:30]1[O:31][CH2:32][CH2:33][CH2:34]1.[CH3:51][OH:52].[Cl:1][c:2]1[c:3]2[n:4]([cH:5][cH:6][c:7]1-[c:8]1[cH:9][cH:10][c:11]([CH3:14])[cH:12][cH:13]1)[c:15](=[O:29])[n:16]([CH2:18][c:19]1[cH:20][n:21][c:22]([C:25]([F:26])([F:27])[F:28])[cH:23][cH:24]1)[n:17]2.[Cl:35][c:36]1[cH:37][cH:38][c:39]([B:42]([OH:43])[OH:44])[cH:40][cH:41]1.[K+:45].[K+:46].[O-:47][C:48]([O-:49])=[O:50]>>[c:2]1(-[c:39]2[cH:38][cH:37][c:36]([Cl:35])[cH:41][cH:40]2)[c:3]2[n:4]([cH:5][cH:6][c:7]1-[c:8]1[cH:9][cH:10][c:11]([CH3:14])[cH:12][cH:13]1)[c:15](=[O:29])[n:16]([CH2:18][c:19]1[cH:20][n:21][c:22]([C:25]([F:26])([F:27])[F:28])[cH:23][cH:24]1)[n:17]2

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 887MethanolHCID 8028TetrahydrofuranHCID 19660Carbonate IonHCID 742994-Chlorophenylboronic acidHCID 577993658-chloro-7-p-tolyl-2-((6-(trifluoromethyl)pyridin-3-yl)methyl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one

Product 1

HCID 160048708-(4-chlorophenyl)-7-p-tolyl-2-((6-(trifluoromethyl)pyridin-3-yl)methyl)-[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one

Sources & evidence

ORD record
ord-7234f7fe9e0243ed97e0b32d78419629
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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