Acetone → (2-Chloro-5-pyridin-4-yl-phenyl)-[6-(2,4-difluoro-phenylamino)-pyridin-3-yl]-methanone

HRID 2348091Notes

Reaction equation

HRID 2348091 reaction equation
[C:31](=[O:32])([O-:33])[O-:34].[CH3:37][C:38](=[O:39])[CH3:40].[Cl:1][c:2]1[c:3]([CH:14]([OH:15])[c:16]2[cH:17][n:18][c:19]([NH:22][c:23]3[c:24]([F:30])[cH:25][c:26]([F:29])[cH:27][cH:28]3)[cH:20][cH:21]2)[cH:4][c:5](-[c:8]2[cH:9][cH:10][n:11][cH:12][cH:13]2)[cH:6][cH:7]1.[Na+:35].[Na+:36]>>[Cl:1][c:2]1[c:3]([C:14](=[O:15])[c:16]2[cH:17][n:18][c:19]([NH:22][c:23]3[c:24]([F:30])[cH:25][c:26]([F:29])[cH:27][cH:28]3)[cH:20][cH:21]2)[cH:4][c:5](-[c:8]2[cH:9][cH:10][n:11][cH:12][cH:13]2)[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 180AcetoneHCID 923Sodium ion2×HCID 19660Carbonate IonHCID 22349577(2-Chloro-5-pyridin-4-yl-phenyl)-[6-(2,4-difluoro-phenylamino)-pyridin-3-yl]-methanol

Product 1

HCID 10295763(2-Chloro-5-pyridin-4-yl-phenyl)-[6-(2,4-difluoro-phenylamino)-pyridin-3-yl]-methanone

Sources & evidence

ORD record
ord-9cec63ece0d84085840cf5ad32c4a520
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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