Methane → 3-{2-Chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1,2,3,6-tetrahydropyrimidin-1-yl]phenoxy}-2-carboxymethoxypyridine

HRID 313496Notes

Reaction equation

HRID 313496 reaction equation
[C:41].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[Cl:1][c:2]1[c:3]([O:4][c:5]2[c:6]([O:11][CH2:12][C:13](=[O:14])[O:15][CH2:16][c:17]3[cH:18][cH:19][cH:20][cH:21][cH:22]3)[n:7][cH:8][cH:9][cH:10]2)[cH:23][c:24](-[n:28]2[c:29](=[O:40])[n:30]([CH3:39])[c:31]([C:35]([F:36])([F:37])[F:38])[cH:32][c:33]2=[O:34])[c:25]([F:27])[cH:26]1.[Pd:42]>>[Cl:1][c:2]1[c:3]([O:4][c:5]2[c:6]([O:11][CH2:12][C:13](=[O:14])[OH:15])[n:7][cH:8][cH:9][cH:10]2)[cH:23][c:24](-[n:28]2[c:29](=[O:40])[n:30]([CH3:39])[c:31]([C:35]([F:36])([F:37])[F:38])[cH:32][c:33]2=[O:34])[c:25]([F:27])[cH:26]1

Participants

5

Reactant 4

HCID 297MethaneHCID 8857Ethyl AcetateHCID 23938PalladiumHCID 186192133-{2-Chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1,2,3,6-tetrahydropyrimidin-1-yl]phenoxy}-2-(benzyloxycarbonyl)methoxypyridine

Product 1

HCID 219335233-{2-Chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1,2,3,6-tetrahydropyrimidin-1-yl]phenoxy}-2-carboxymethoxypyridine

Sources & evidence

ORD record
ord-cc33601b36f8482fb285152a98ef58c5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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