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Hydrochloric Acid → 1-(6-Amino-3,5-difluoropyridin-2-yl)-6,8-difluoro-7-(3-methylaminoazetidin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

HRID 171686
Notes
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Reaction equation

HRID 171686 reaction equation
[CH3:1][N:2]([CH3:3])[CH:4]=[O:5].[CH3:34][NH:35][CH:36]1[CH2:37][NH:38][CH2:39]1.[CH3:40][N:41]1[CH2:42][CH2:43][CH2:44][CH2:45]1.[CH3:46][CH2:47][OH:48].[ClH:32].[ClH:33].[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]([F: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:38]4[CH2:37][CH:36]([NH:35][CH3:34])[CH2:39]4)[c:21]([F:23])[c:22]23)[n:12]1
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 313Hydrochloric Acid2×HCID 702EthanolHCID 6228DimethylformamideHCID 84541-MethylpyrrolidineHCID 10086969N-methylazetidin-3-amineHCID 221211661-(6-Amino-3,5-difluoropyridin-2-yl)-6,7,8-trifluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

Product 1

HCID 221212321-(6-Amino-3,5-difluoropyridin-2-yl)-6,8-difluoro-7-(3-methylaminoazetidin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

Sources & evidence

ORD record
ord-75a169be7aa446a4909d5cf356ae8f6b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes