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Hydrochloric Acid → 1-Cyclopropyl-6,8-difluoro-5-methyl-7-[3-(1,2,4-triazol-1-yl)-pyrrolidin-1-yl]-1,4-dihydro-4-oxoquinoline-3-carboxylic acid

HRID 100314
Notes
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Reaction equation

HRID 100314 reaction equation
[CH2:33]1[CH2:34][CH2:35][C:36]2=[N:41][CH2:40][CH2:39][CH2:38][N:37]2[CH2:42][CH2:43]1.[CH:1]1([n:4]2[cH:5][c:6]([C:19](=[O:20])[OH:21])[c:7](=[O:18])[c:8]3[c:9]([CH3:17])[c:10]([F:16])[c:11]([F:15])[c:12]([F:14])[c:13]23)[CH2:2][CH2:3]1.[ClH:22].[cH:44]1[cH:45][cH:46][n:47][cH:48][cH:49]1.[n:23]1([CH:28]2[CH2:29][NH:30][CH2:31][CH2:32]2)[n:24][cH:25][n:26][cH:27]1>>[CH:1]1([n:4]2[cH:5][c:6]([C:19](=[O:20])[OH:21])[c:7](=[O:18])[c:8]3[c:9]([CH3:17])[c:10]([F:16])[c:11]([N:30]4[CH2:29][CH:28]([n:23]5[n:24][cH:25][n:26][cH:27]5)[CH2:32][CH2:31]4)[c:12]([F:14])[c:13]23)[CH2:2][CH2:3]1
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 1049PyridineHCID 811841,8-Diazabicyclo(5.4.0)undec-7-eneHCID 146512581-Cyclopropyl-5-methyl-6,7,8-trifluoro-1,4-dihydro-4-oxoquinoline-3-carboxylic acidHCID 190059951-(pyrrolidin-3-yl)-1H-1,2,4-triazole

Product 1

HCID 19006005
1-Cyclopropyl-6,8-difluoro-5-methyl-7-[3-(1,2,4-triazol-1-yl)-pyrrolidin-1-yl]-1,4-dihydro-4-oxoquinoline-3-carboxylic acid

Sources & evidence

ORD record
ord-f5245cad90f94191b4b3d019bdc058cb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes