Dimethylformamide → 6-[2-(4-Chlorophenyl)ethenyl]-3-[4-[(3,3-difluoro-1-hydroxycyclobutyl)methoxy]-3-methoxyphenyl]pyrimidin-4-one

HRID 1124263Notes

Reaction equation

HRID 1124263 reaction equation
[Br:23][c:24]1[cH:25][c:26]([O:39][CH3:40])[c:27]([O:28][CH2:29][C:30]2([OH:36])[CH2:31][C:32]([F:34])([F:35])[CH2:33]2)[cH:37][cH:38]1.[CH3:1][NH:2][CH2:3][CH2:4][NH:5][CH3:6].[Cl:7][c:8]1[cH:9][cH:10][c:11]([CH:12]=[CH:13][c:14]2[cH:15][c:16](=[O:20])[nH:17][cH:18][n:19]2)[cH:21][cH:22]1.[Cu:46][I:47].[O:41]=[CH:42][N:43]([CH3:44])[CH3:45]>>[Cl:7][c:8]1[cH:9][cH:10][c:11]([CH:12]=[CH:13][c:14]2[cH:15][c:16](=[O:20])[n:17](-[c:24]3[cH:25][c:26]([O:39][CH3:40])[c:27]([O:28][CH2:29][C:30]4([OH:36])[CH2:31][C:32]([F:34])([F:35])[CH2:33]4)[cH:37][cH:38]3)[cH:18][n:19]2)[cH:21][cH:22]1

Participants

6

Reactant 5

HCID 6228DimethylformamideHCID 8070N,N'-DimethylethylenediamineHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 679984481-((4-Bromo-2-methoxyphenoxy)methyl)-3,3-difluorocyclobutanolHCID 1366524834-[2-(4-chlorophenyl)ethenyl]-1H-pyrimidin-6-one

Product 1

HCID 679977726-[2-(4-Chlorophenyl)ethenyl]-3-[4-[(3,3-difluoro-1-hydroxycyclobutyl)methoxy]-3-methoxyphenyl]pyrimidin-4-one

Sources & evidence

ORD record
ord-dff9fc1ca55e4c608b59e32d44dfed01
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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