Dimethyl Sulfoxide → 1-Cyclopropyl-6,8-difluoro-7-(morpholin-4-yl)-1,4-dihydro-4-oxoquinoline-3-carboxylic acid

HRID 191743

Reaction equation

HRID 191743 reaction equation
[CH2:21]1[CH2:22][O:23][CH2:24][CH2:25][NH:26]1.[CH3:35][S:36](=[O:37])[CH3:38].[CH:1]1([n:4]2[cH:5][c:6]([C:18](=[O:19])[OH:20])[c:7](=[O:17])[c:8]3[cH:9][c:10]([F:16])[c:11]([F:15])[c:12]([F:14])[c:13]23)[CH2:2][CH2:3]1.[N:27]12[CH2:28][CH2:29][CH:30]([CH2:31][CH2:32]1)[CH2:33][NH:34]2>>[CH:1]1([n:4]2[cH:5][c:6]([C:18](=[O:19])[OH:20])[c:7](=[O:17])[c:8]3[cH:9][c:10]([F:16])[c:11]([N:26]4[CH2:21][CH2:22][O:23][CH2:24][CH2:25]4)[c:12]([F:14])[c:13]23)[CH2:2][CH2:3]1

Participants

5

Reactant 4

HCID 679Dimethyl SulfoxideHCID 8083MorpholineHCID 136165Diazabicyclo(2.2.2)octaneHCID 5354141-Cyclopropyl-6,7,8-trifluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

Product 1

HCID 133655531-Cyclopropyl-6,8-difluoro-7-(morpholin-4-yl)-1,4-dihydro-4-oxoquinoline-3-carboxylic acid

Sources & evidence

ORD record
ord-98a5317f12e446bf94d3552063722819
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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