Methanesulfonic Acid → 8-(3-Amino-3-methyl-1-azetidinyl)-1-cyclopropyl-7-fluoro-4-oxo-1,4-dihydrobenzo[b][1,8]naphthyridine-3-carboxylic acid

HRID 2315657Notes

Reaction equation

HRID 2315657 reaction equation
[CH3:24][S:25]([OH:26])(=[O:27])=[O:28].[CH3:29][S:30]([OH:31])(=[O:32])=[O:33].[CH:1]1([n:4]2[cH:5][c:6]([C:21](=[O:22])[OH:23])[c:7](=[O:20])[c:8]3[cH:9][c:10]4[c:11]([n:12][c:13]23)[cH:14][c:15]([F:19])[c:16]([F:18])[cH:17]4)[CH2:2][CH2:3]1.[NH2:34][C:35]1([CH3:39])[CH2:36][NH:37][CH2:38]1>>[CH:1]1([n:4]2[cH:5][c:6]([C:21](=[O:22])[OH:23])[c:7](=[O:20])[c:8]3[cH:9][c:10]4[c:11]([n:12][c:13]23)[cH:14][c:15]([N:37]2[CH2:36][C:35]([NH2:34])([CH3:39])[CH2:38]2)[c:16]([F:18])[cH:17]4)[CH2:2][CH2:3]1

Participants

4

Reactant 3

HCID 6395Methanesulfonic Acid2×HCID 103292483-Methylazetidin-3-amineHCID 148533411-Cyclopropyl-7,8-difluoro-4-oxo-1,4-dihydrobenzo[b][1,8]naphthyridine-3-carboxylic acid

Product 1

HCID 194236498-(3-Amino-3-methyl-1-azetidinyl)-1-cyclopropyl-7-fluoro-4-oxo-1,4-dihydrobenzo[b][1,8]naphthyridine-3-carboxylic acid

Sources & evidence

ORD record
ord-171ca79bbad2417c83687eb2801fdd77
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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