Potassium Cation → 7-(1-Methyl-5-indolyl)-1-phenyl-5-trifluoromethylbenzimidazole

HRID 1150366Notes

Reaction equation

HRID 1150366 reaction equation
[C:39](=[O:40])([O-:41])[O-:42].[CH2:34]([OH:35])[CH2:36][CH2:37][OH:38].[CH2:45]([CH2:46][O:47][CH3:48])[O:49][CH3:50].[CH3:21][n:22]1[cH:23][cH:24][c:25]2[cH:26][c:27]([B:31]([OH:32])[OH:33])[cH:28][cH:29][c:30]12.[I:1][c:2]1[cH:3][c:4]([C:17]([F:18])([F:19])[F:20])[cH:5][c:6]2[c:7]1[n:8](-[c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)[cH:9][n:10]2.[K+:43].[K+:44].[OH2:51]>>[c:2]1(-[c:27]2[cH:26][c:25]3[cH:24][cH:23][n:22]([CH3:21])[c:30]3[cH:29][cH:28]2)[cH:3][c:4]([C:17]([F:18])([F:19])[F:20])[cH:5][c:6]2[c:7]1[n:8](-[c:11]1[cH:12][cH:13][cH:14][cH:15][cH:16]1)[cH:9][n:10]2

Participants

8

Reactant 7

HCID 813Potassium Cation2×HCID 962WaterHCID 80711,2-DimethoxyethaneHCID 104421,3-PropanediolHCID 19660Carbonate IonHCID 27598671-Methyl-1H-indole-5-boronic acidHCID 194260247-Iodo-1-phenyl-5-(trifluoromethyl)-1H-benzimidazole

Product 1

HCID 114179227-(1-Methyl-5-indolyl)-1-phenyl-5-trifluoromethylbenzimidazole

Sources & evidence

ORD record
ord-c118ff2ead23411da78bcf56b7d46046
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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