Hydrochloric Acid → Ethyl 7-(3-aminopyrrolidin-1-yl)-1-(2,4-difluorophenyl)-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylate

HRID 2348418Notes

Reaction equation

HRID 2348418 reaction equation
[CH3:58][CH2:59][OH:60].[CH3:9][CH2:10][N:11]([CH2:12][CH3:13])[CH2:14][CH3:15].[ClH:1].[ClH:2].[F:16][c:17]1[c:18](-[n:24]2[cH:25][c:26]([C:53](=[O:54])[O:55][CH2:56][CH3:57])[c:27](=[O:52])[c:28]3[cH:29][c:30]([F:51])[c:31]([O:34][P:35]([O:36][c:37]4[cH:38][cH:39][cH:40][cH:41][cH:42]4)([O:43][c:44]4[cH:45][cH:46][cH:47][cH:48][cH:49]4)=[O:50])[n:32][c:33]23)[cH:19][cH:20][c:21]([F:23])[cH:22]1.[NH2:3][CH:4]1[CH2:5][NH:6][CH2:7][CH2:8]1>>[NH2:3][CH:4]1[CH2:5][N:6]([c:31]2[c:30]([F:51])[cH:29][c:28]3[c:27](=[O:52])[c:26]([C:53](=[O:54])[O:55][CH2:56][CH3:57])[cH:25][n:24](-[c:18]4[c:17]([F:16])[cH:22][c:21]([F:23])[cH:20][cH:19]4)[c:33]3[n:32]2)[CH2:7][CH2:8]1

Participants

6

Reactant 5

HCID 313Hydrochloric Acid2×HCID 702EthanolHCID 8471TriethylamineHCID 1644013-AminopyrrolidineHCID 13849344Ethyl 1-(2,4-difluorophenyl)-7-diphenoxyphosphinyloxy-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylate

Product 1

HCID 13667039Ethyl 7-(3-aminopyrrolidin-1-yl)-1-(2,4-difluorophenyl)-6-fluoro-4-oxo-1,8-naphthyridine-3-carboxylate

Sources & evidence

ORD record
ord-e750a107fee14496b5b14a26c6593e62
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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