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

HRID 97666Notes

Reaction equation

HRID 97666 reaction equation
[CH3:24][S:25]([OH:26])(=[O:27])=[O:28].[CH3:29][S:30]([OH:31])(=[O:32])=[O:33].[CH3:34][C:35]1([NH:39][CH3:40])[CH2:36][NH:37][CH2:38]1.[F:1][c:2]1[cH:3][c:4]2[c:5]([n:6][c:7]3[n:8]([CH:18]4[CH2:19][CH2:20]4)[cH:9][c:10]([C:15](=[O:16])[OH:17])[c:11](=[O:14])[c:12]3[cH:13]2)[cH:21][c:22]1[F:23]>>[F:1][c:2]1[cH:3][c:4]2[c:5]([n:6][c:7]3[n:8]([CH:18]4[CH2:19][CH2:20]4)[cH:9][c:10]([C:15](=[O:16])[OH:17])[c:11](=[O:14])[c:12]3[cH:13]2)[cH:21][c:22]1[N:37]1[CH2:36][C:35]([CH3:34])([NH:39][CH3:40])[CH2:38]1

Participants

4

Reactant 3

HCID 6395Methanesulfonic Acid2×HCID 148533411-Cyclopropyl-7,8-difluoro-4-oxo-1,4-dihydrobenzo[b][1,8]naphthyridine-3-carboxylic acidHCID 19423737N,3-Dimethyl-3-azetidinamine

Product 1

HCID 194237081-Cyclopropyl-7-fluoro-8-(3-methyl-3-methylamino-1-azetidinyl)-4-oxo-1,4-dihydrobenzo[b][1,8]naphthyridine-3-carboxylic acid

Sources & evidence

ORD record
ord-0dda502601594193816026e9ee96c442
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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