Dimethylformamide → 2-(4-{4-[2-(3,5-Dimethyl-isoxazol-4-yl)-acetylamino]-2-fluoro-phenyl}-piperazin-1-yl)-N,N-diethyl-2-phenyl-acetamide

HRID 205848Notes

Reaction equation

HRID 205848 reaction equation
[CH3:1][c:2]1[n:3][o:4][c:5]([CH3:11])[c:6]1[CH2:7][C:8](=[O:9])[OH:10].[NH2:12][c:13]1[cH:14][c:15]([F:39])[c:16]([N:19]2[CH2:20][CH2:21][N:22]([CH:25]([C:26](=[O:27])[N:28]([CH2:29][CH3:30])[CH2:31][CH3:32])[c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[CH2:23][CH2:24]2)[cH:17][cH:18]1.[O:40]=[CH:41][N:42]([CH3:43])[CH3:44]>>[CH3:1][c:2]1[n:3][o:4][c:5]([CH3:11])[c:6]1[CH2:7][C:8](=[O:10])[NH:12][c:13]1[cH:14][c:15]([F:39])[c:16]([N:19]2[CH2:20][CH2:21][N:22]([CH:25]([C:26](=[O:27])[N:28]([CH2:29][CH3:30])[CH2:31][CH3:32])[c:33]3[cH:34][cH:35][cH:36][cH:37][cH:38]3)[CH2:23][CH2:24]2)[cH:17][cH:18]1

Participants

4

Reactant 3

HCID 6228DimethylformamideHCID 20633382-(Dimethyl-1,2-oxazol-4-yl)acetic acidHCID 581573072-[4-(4-amino-2-fluoro-phenyl)-piperazin-1-yl]-N,N-diethyl-2-phenyl-acetamide

Product 1

HCID 166671812-(4-{4-[2-(3,5-Dimethyl-isoxazol-4-yl)-acetylamino]-2-fluoro-phenyl}-piperazin-1-yl)-N,N-diethyl-2-phenyl-acetamide

Sources & evidence

ORD record
ord-cafa5353d2324b67b8f7e3823e96089b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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