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Hydrochloric Acid → 7-(3-Aminoazetidin-1-yl)-8-chloro-1-(3,5-difluoro-6-methoxypyridin-2-yl)-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

HRID 316490
Notes
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Reaction equation

HRID 316490 reaction equation
[CH3:35][N:36]1[CH2:37][CH2:38][CH2:39][CH2:40]1.[CH3:41][C:42]#[N:43].[Cl:1][c:2]1[c:3]([F:27])[c:4]([F:26])[cH:5][c:6]2[c:7](=[O:25])[c:8]([C:22](=[O:23])[OH:24])[cH:9][n:10](-[c:12]3[n:13][c:14]([O:20][CH3:21])[c:15]([F:19])[cH:16][c:17]3[F:18])[c:11]12.[ClH:28].[ClH:29].[NH2:30][CH:31]1[CH2:32][NH:33][CH2:34]1>>[Cl:1][c:2]1[c:3]([N:33]2[CH2:32][CH:31]([NH2:30])[CH2:34]2)[c:4]([F:26])[cH:5][c:6]2[c:7](=[O:25])[c:8]([C:22](=[O:23])[OH:24])[cH:9][n:10](-[c:12]3[n:13][c:14]([O:20][CH3:21])[c:15]([F:19])[cH:16][c:17]3[F:18])[c:11]12
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 313Hydrochloric Acid2×HCID 6342AcetonitrileHCID 84541-MethylpyrrolidineHCID 1516506Azetidin-3-amineHCID 221212448-Chloro-1-(3,5-difluoro-6-methoxypyridin-2-yl)-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

Product 1

HCID 22121285
7-(3-Aminoazetidin-1-yl)-8-chloro-1-(3,5-difluoro-6-methoxypyridin-2-yl)-6-fluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

Sources & evidence

ORD record
ord-df9de3bfe9f3489d8c1d91d4b25e3b90
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes