Potassium Cation → (RS)-1-{2-[5,6-difluoro-1-(2-hydroxy-ethyl)-1H-benzoimidazol-2-ylmethyl]-piperidin-1-yl}-1-[5-(4-fluoro-phenyl)-2-methyl-thiazol-4-yl]-methanone

HRID 137386Notes

Reaction equation

HRID 137386 reaction equation
[Br:36][CH2:37][CH2:38][OH:39].[C:40](=[O:41])([O-:42])[O-:43].[CH:46]([N:47]([CH2:48][CH3:49])[CH:50]([CH3:51])[CH3:52])([CH3:53])[CH3:54].[F:1][c:2]1[cH:3][c:4]2[c:5]([nH:6][c:7]([CH2:9][CH:10]3[N:11]([C:16](=[O:17])[c:18]4[n:19][c:20]([CH3:30])[s:21][c:22]4-[c:23]4[cH:24][cH:25][c:26]([F:29])[cH:27][cH:28]4)[CH2:12][CH2:13][CH2:14][CH2:15]3)[n:8]2)[cH:31][c:32]1[F:33].[H-:34].[K+:44].[K+:45].[Na+:35].[O:55]=[CH:56][N:57]([CH3:58])[CH3:59]>>[F:1][c:2]1[cH:3][c:4]2[c:5]([n:6]([CH2:37][CH2:38][OH:39])[c:7]([CH2:9][CH:10]3[N:11]([C:16](=[O:17])[c:18]4[n:19][c:20]([CH3:30])[s:21][c:22]4-[c:23]4[cH:24][cH:25][c:26]([F:29])[cH:27][cH:28]4)[CH2:12][CH2:13][CH2:14][CH2:15]3)[n:8]2)[cH:31][c:32]1[F:33]

Participants

9

Reactant 8

HCID 813Potassium Cation2×HCID 923Sodium ionHCID 6228DimethylformamideHCID 108982-BromoethanolHCID 19660Carbonate IonHCID 81531DiisopropylethylamineHCID 166653HydrideHCID 17973672(RS)-1-[2-(5,6-Difluoro-1H-benzoimidazol-2-ylmethyl)-piperidin-1-yl]-1-[5-(4-fluoro-phenyl)-2-methyl-thiazol-4-yl]-methanone

Product 1

HCID 17973689(RS)-1-{2-[5,6-difluoro-1-(2-hydroxy-ethyl)-1H-benzoimidazol-2-ylmethyl]-piperidin-1-yl}-1-[5-(4-fluoro-phenyl)-2-methyl-thiazol-4-yl]-methanone

Sources & evidence

ORD record
ord-18bedd6dd39543f78ab900e52f47678c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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