Acetic Acid → (4-Amino-3,5-difluoro-phenyl)-(4-ethyl-piperazin-1-yl)-methanone

HRID 1125710Notes

Reaction equation

HRID 1125710 reaction equation
[CH3:29][C:30](=[O:31])[OH:32].[CH3:33][OH:34].[F:1][c:2]1[cH:3][c:4]([C:19](=[O:20])[N:21]2[CH2:22][CH2:23][N:24]([CH2:27][CH3:28])[CH2:25][CH2:26]2)[cH:5][c:6]([F:18])[c:7]1[NH:8][CH2:9][c:10]1[cH:11][cH:12][c:13]([O:14][CH3:15])[cH:16][cH:17]1.[Pd:35]>>[F:1][c:2]1[cH:3][c:4]([C:19](=[O:20])[N:21]2[CH2:22][CH2:23][N:24]([CH2:27][CH3:28])[CH2:25][CH2:26]2)[cH:5][c:6]([F:18])[c:7]1[NH2:8]

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 887MethanolHCID 23938PalladiumHCID 59244390[3,5-Difluoro-4-(4-methoxy-benzylamino)-phenyl]-(4-ethyl-piperazin-1-yl)-methanone

Product 1

HCID 55160008(4-Amino-3,5-difluoro-phenyl)-(4-ethyl-piperazin-1-yl)-methanone

Sources & evidence

ORD record
ord-160dcc88027b4075a774e2eca4ececf9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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