Potassium Cation → methyl 5-(6-methoxy-1H-imidazo[4,5-c]pyridin-1-yl)-3-{[2-(trifluoromethyl)benzyl]oxy}thiophene-2-carboxylate

HRID 144596

Reaction equation

HRID 144596 reaction equation
[Br:49][CH2:50][c:51]1[c:52]([C:57]([F:58])([F:59])[F:60])[cH:53][cH:54][cH:55][cH:56]1.[CH3:61][N:62]([CH3:63])[CH:64]=[O:65].[K+:43].[K+:44].[O-:45][C:46]([O-:47])=[O:48].[OH2:66].[OH:1][c:2]1[cH:3][c:4](-[n:5]2[c:6]3[cH:7][n:8][c:9]([O:10][CH3:11])[cH:12][c:13]3[n:14][cH:15]2)[s:16][c:17]1[C:18]([O:19][CH3:20])=[O:21].[OH:22][c:23]1[c:24]([C:39](=[O:40])[O:41][CH3:42])[s:25][c:26](-[n:28]2[cH:29][n:30][c:31]3[cH:32][n:33][c:34]([O:37][CH3:38])[cH:35][c:36]23)[cH:27]1>>[O:22]([c:23]1[c:24]([C:39](=[O:40])[O:41][CH3:42])[s:25][c:26](-[n:28]2[cH:29][n:30][c:31]3[cH:32][n:33][c:34]([O:37][CH3:38])[cH:35][c:36]23)[cH:27]1)[CH2:50][c:51]1[c:52]([C:57]([F:58])([F:59])[F:60])[cH:53][cH:54][cH:55][cH:56]1

Participants

8

Reactant 7

HCID 813Potassium Cation2×HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 1230571-(Bromomethyl)-2-(trifluoromethyl)benzeneHCID 68765328methyl 3-hydroxy-5-(6-methoxy-1H-imidazo[4,5-c]pyridin-1-yl)thiophene-2-carboxylateHCID 68768518methyl 3-hydroxy-5-(6-methoxy-3H-imidazo[4,5-c]pyridin-3-yl)thiophene-2-carboxylate

Product 1

HCID 68766502methyl 5-(6-methoxy-1H-imidazo[4,5-c]pyridin-1-yl)-3-{[2-(trifluoromethyl)benzyl]oxy}thiophene-2-carboxylate

Sources & evidence

ORD record
ord-2643fca67dfc426aafe7fe386903d6fa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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