Ethanol → 1-(6-Amino-3,5-difluoropyridin-2-yl)-8-chloro-6-fluoro-4-oxo-7-piperazino-1,4-dihydroquinoline-3-carboxylic acid

HRID 1562747Notes

Reaction equation

HRID 1562747 reaction equation
[CH2:32]1[CH2:33][NH:34][CH2:35][CH2:36][NH:37]1.[CH3:1][N:2]([CH3:3])[CH:4]=[O:5].[CH3:38][CH2:39][OH:40].[NH2:6][c:7]1[c:8]([F:31])[cH:9][c:10]([F:30])[c:11](-[n:13]2[cH:14][c:15]([C:27](=[O:28])[OH:29])[c:16](=[O:26])[c:17]3[cH:18][c:19]([F:25])[c:20]([F:24])[c:21]([Cl:23])[c:22]23)[n:12]1>>[NH2:6][c:7]1[c:8]([F:31])[cH:9][c:10]([F:30])[c:11](-[n:13]2[cH:14][c:15]([C:27](=[O:28])[OH:29])[c:16](=[O:26])[c:17]3[cH:18][c:19]([F:25])[c:20]([N:34]4[CH2:33][CH2:32][NH:37][CH2:36][CH2:35]4)[c:21]([Cl:23])[c:22]23)[n:12]1

Participants

5

Reactant 4

HCID 702EthanolHCID 4837PiperazineHCID 6228DimethylformamideHCID 154349011-(6-Amino-3,5-difluoro-2-pyridinyl)-8-chloro-6,7-difluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid

Product 1

HCID 154869791-(6-Amino-3,5-difluoropyridin-2-yl)-8-chloro-6-fluoro-4-oxo-7-piperazino-1,4-dihydroquinoline-3-carboxylic acid

Sources & evidence

ORD record
ord-c6920a80316148838beef68e89ae9e43
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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