Methyl 4-hydroxy-3,5-dimethylbenzoate → 4-{2-Cyclohexyl-2-[2-(2,6-dimethoxy-pyridin-3-yl)-5,6-difluoro-benzoimidazol-1-yl]-ethoxy}-3,5-dimethyl-benzoic acid methyl ester

HRID 118083Notes

Reaction equation

HRID 118083 reaction equation
[CH3:40][O:41][C:42]([c:43]1[cH:44][c:45]([CH3:51])[c:46]([OH:50])[c:47]([CH3:49])[cH:48]1)=[O:52].[CH:1]1([CH:7]([CH2:8][O:9][c:10]2[cH:11][cH:12][c:13]([C:14]([OH:15])=[O:16])[cH:17][n:18]2)[n:19]2[c:20](-[c:30]3[c:31]([O:38][CH3:39])[n:32][c:33]([O:36][CH3:37])[cH:34][cH:35]3)[n:21][c:22]3[c:23]2[cH:24][c:25]([F:29])[c:26]([F:28])[cH:27]3)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1>>[CH:1]1([CH:7]([CH2:8][O:50][c:46]2[c:45]([CH3:51])[cH:44][c:43]([C:42]([O:41][CH3:40])=[O:52])[cH:48][c:47]2[CH3:49])[n:19]2[c:20](-[c:30]3[c:31]([O:38][CH3:39])[n:32][c:33]([O:36][CH3:37])[cH:34][cH:35]3)[n:21][c:22]3[c:23]2[cH:24][c:25]([F:29])[c:26]([F:28])[cH:27]3)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

3

Reactant 2

HCID 12389264Methyl 4-hydroxy-3,5-dimethylbenzoateHCID 461857196-{2-Cyclohexyl-2-[2-(2,6-dimethoxy-pyridin-3-yl)-5,6-difluoro-benzoimidazol-1-yl]-ethoxy}-nicotinic acid

Product 1

HCID 666192674-{2-Cyclohexyl-2-[2-(2,6-dimethoxy-pyridin-3-yl)-5,6-difluoro-benzoimidazol-1-yl]-ethoxy}-3,5-dimethyl-benzoic acid methyl ester

Sources & evidence

ORD record
ord-de4b47a9e1854c528838135b131da0ec
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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