Dimethylformamide → 2-(3-Fluoro-phenyl)-4-methyl-pyrimidine-5-carboxylic acid (5-fluoro-3-methyl-pyrrolo[3,2-b]pyridin-1-yl)-amide

HRID 1207056Notes

Reaction equation

HRID 1207056 reaction equation
[CH:30]([N:31]([CH2:32][CH3:33])[CH:34]([CH3:35])[CH3:36])([CH3:37])[CH3:38].[F:18][c:19]1[cH:20][cH:21][c:22]2[c:23]([n:24]1)[c:25]([CH3:29])[cH:26][n:27]2[NH2:28].[F:1][c:2]1[cH:3][c:4](-[c:8]2[n:9][cH:10][c:11]([C:15](=[O:16])[OH:17])[c:12]([CH3:14])[n:13]2)[cH:5][cH:6][cH:7]1.[O:63]=[CH:64][N:65]([CH3:66])[CH3:67].[P-:39]([F:40])([F:41])([F:42])([F:43])([F:44])[F:45].[n:46]1([O:47][C:48]([N:49]([CH3:50])[CH3:51])=[N+:52]([CH3:53])[CH3:54])[c:55]2[n:56][cH:57][cH:58][cH:59][c:60]2[n:61][n:62]1>>[F:1][c:2]1[cH:3][c:4](-[c:8]2[n:9][cH:10][c:11]([C:15](=[O:17])[NH:28][n:27]3[c:22]4[cH:21][cH:20][c:19]([F:18])[n:24][c:23]4[c:25]([CH3:29])[cH:26]3)[c:12]([CH3:14])[n:13]2)[cH:5][cH:6][cH:7]1

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 617025872-(3-Fluorophenyl)-4-methylpyrimidine-5-carboxylic acidHCID 685521755-Fluoro-3-methyl-pyrrolo[3,2-b]pyridin-1-ylamine

Product 1

HCID 591999862-(3-Fluoro-phenyl)-4-methyl-pyrimidine-5-carboxylic acid (5-fluoro-3-methyl-pyrrolo[3,2-b]pyridin-1-yl)-amide

Sources & evidence

ORD record
ord-d7449cbf4e8847a5aafc7355ae0c1c00
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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