Hydrochloric Acid → 1-Cyclopropyl-6-fluoro-7-(3-dimethylamino-1-azetidinyl)-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid

HRID 665545Notes

Reaction equation

HRID 665545 reaction equation
[CH3:22][N:23]([CH:24]1[CH2:25][NH:26][CH2:27]1)[CH3:28].[CH3:29][CH2:30][N:31]([CH2:32][CH3:33])[CH2:34][CH3:35].[CH:1]1([n:4]2[cH:5][c:6]([C:17](=[O:18])[OH:19])[c:7](=[O:16])[c:8]3[cH:9][c:10]([F:15])[c:11]([F:14])[cH:12][c:13]23)[CH2:2][CH2:3]1.[ClH:20].[ClH:21]>>[CH:1]1([n:4]2[cH:5][c:6]([C:17](=[O:18])[OH:19])[c:7](=[O:16])[c:8]3[cH:9][c:10]([F:15])[c:11]([N:26]4[CH2:25][CH:24]([N:23]([CH3:22])[CH3:28])[CH2:27]4)[cH:12][c:13]23)[CH2:2][CH2:3]1

Participants

5

Reactant 4

HCID 313Hydrochloric Acid2×HCID 8471TriethylamineHCID 52104221-Cyclopropyl-6,7-difluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acidHCID 10351656N,N-dimethylazetidin-3-amine

Product 1

HCID 100431761-Cyclopropyl-6-fluoro-7-(3-dimethylamino-1-azetidinyl)-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid

Sources & evidence

ORD record
ord-3e64437630c7489186c45c45f5529ca6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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