Ammonium → N-[5-(4-Methylpiperazin-1-yl)-3,4 dihydro-2H-1-benzopyran-3-yl]-4-(piperazin-1-yl)benzamide

HRID 1235418Notes

Reaction equation

HRID 1235418 reaction equation
[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([c:8]2[cH:9][cH:10][cH:11][c:12]3[c:13]2[CH2:14][CH:15]([NH:18][C:19]([c:20]2[cH:21][cH:22][c:23]([N:26]4[CH2:27][CH2:28][N:29]([CH2:32][c:33]5[cH:34][cH:35][cH:36][cH:37][cH:38]5)[CH2:30][CH2:31]4)[cH:24][cH:25]2)=[O:39])[CH2:16][O:17]3)[CH2:6][CH2:7]1.[CH3:44][OH:45].[CH:40]([O-:41])=[O:42].[NH4+:43].[Pd:46]>>[CH3:1][N:2]1[CH2:3][CH2:4][N:5]([c:8]2[cH:9][cH:10][cH:11][c:12]3[c:13]2[CH2:14][CH:15]([NH:18][C:19]([c:20]2[cH:21][cH:22][c:23]([N:26]4[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]4)[cH:24][cH:25]2)=[O:39])[CH2:16][O:17]3)[CH2:6][CH2:7]1

Participants

6

Reactant 5

HCID 223AmmoniumHCID 283FormateHCID 887MethanolHCID 23938PalladiumHCID 99366704-(4-benzylpiperazin-1-yl)-N-[5-(4-methylpiperazin-1-yl)-3,4-dihydro-2H-chromen-3-yl]benzamide

Product 1

HCID 9824299N-[5-(4-Methylpiperazin-1-yl)-3,4 dihydro-2H-1-benzopyran-3-yl]-4-(piperazin-1-yl)benzamide

Sources & evidence

ORD record
ord-258c4f0788534728886add12726350a9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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