Methanol → 4-Hydroxy-2,2-dimethyl-4-[5-[3-methyl-5-[[4-(trifluoromethyl)pyrimidin-2-yl]amino]phenyl]-1,3-thiazol-2-yl]cyclohexane-1-carboxylic acid

HRID 809944Notes

Reaction equation

HRID 809944 reaction equation
[CH2:49]1[O:50][CH2:51][CH2:52][CH2:53]1.[CH3:1][c:2]1[cH:3][c:4]([NH:13][c:14]2[n:15][cH:16][cH:17][c:18]([C:20]([F:21])([F:22])[F:23])[n:19]2)[cH:5][c:6](-[c:8]2[cH:9][n:10][cH:11][s:12]2)[cH:7]1.[CH3:32][C:33]1([CH3:43])[CH:34]([C:40](=[O:41])[OH:42])[CH2:35][CH2:36][C:37](=[O:39])[CH2:38]1.[CH3:55][OH:56].[CH:24]([N-:25][CH:26]([CH3:27])[CH3:28])([CH3:29])[CH3:30].[Li+:31].[OH2:54].[cH:44]1[n:45][cH:46][s:47][cH:48]1>>[CH3:1][c:2]1[cH:3][c:4]([NH:13][c:14]2[n:15][cH:16][cH:17][c:18]([C:20]([F:21])([F:22])[F:23])[n:19]2)[cH:5][c:6](-[c:8]2[cH:9][n:10][c:11]([C:37]3([OH:39])[CH2:36][CH2:35][CH:34]([C:40](=[O:41])[OH:42])[C:33]([CH3:32])([CH3:43])[CH2:38]3)[s:12]2)[cH:7]1

Participants

9

Reactant 8

HCID 887MethanolHCID 962WaterHCID 8028TetrahydrofuranHCID 9256ThiazoleHCID 28486Lithium ionHCID 5062348DiisopropylamideHCID 529112052,2-Dimethyl-4-oxocyclohexane-1-carboxylic acidHCID 58456403N-[3-methyl-5-(1,3-thiazol-5-yl)phenyl]-4-(trifluoromethyl)pyrimidin-2-amine

Product 1

HCID 759923334-Hydroxy-2,2-dimethyl-4-[5-[3-methyl-5-[[4-(trifluoromethyl)pyrimidin-2-yl]amino]phenyl]-1,3-thiazol-2-yl]cyclohexane-1-carboxylic acid

Sources & evidence

ORD record
ord-3b4a3b576aae437a925416d7069ca17a
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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