Chloride → benzyl 2-[3-({[4-fluoro-2-(methylsulfonyl)benzyl]amino}carbonyl)-4-hydroxy-2-oxo-1,5-naphthyridin-1(2H)-yl]ethyl(methyl)carbamate

HRID 284666Notes

Reaction equation

HRID 284666 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[N:11]([CH2:12][CH2:13][n:14]1[c:15](=[O:29])[c:16]([C:25](=[O:26])[O:27][CH3:28])[c:17]([OH:24])[c:18]2[n:19][cH:20][cH:21][cH:22][c:23]12)[CH3:30].[CH3:54][OH:55].[CH:31]([N:32]([CH2:33][CH3:34])[CH:35]([CH3:36])[CH3:37])([CH3:38])[CH3:39].[Cl-:40].[F:41][c:42]1[cH:43][c:44]([S:50](=[O:51])(=[O:52])[CH3:53])[c:45]([CH2:48][NH3+:49])[cH:46][cH:47]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[N:11]([CH2:12][CH2:13][n:14]1[c:15](=[O:29])[c:16]([C:25](=[O:26])[NH:49][CH2:48][c:45]2[c:44]([S:50](=[O:51])(=[O:52])[CH3:53])[cH:43][c:42]([F:41])[cH:47][cH:46]2)[c:17]([OH:24])[c:18]2[n:19][cH:20][cH:21][cH:22][c:23]12)[CH3:30]

Participants

6

Reactant 5

HCID 312ChlorideHCID 887MethanolHCID 81531DiisopropylethylamineHCID 58977989Methyl 1-{2-[[(benzyloxy)carbonyl](methyl)amino]ethyl}-4-hydroxy-2-oxo-1,2-dihydro-1,5-naphthyridine-3-carboxylateHCID 58977999(4-Fluoro-2-methylsulfonylphenyl)methylazanium

Product 1

HCID 58977990benzyl 2-[3-({[4-fluoro-2-(methylsulfonyl)benzyl]amino}carbonyl)-4-hydroxy-2-oxo-1,5-naphthyridin-1(2H)-yl]ethyl(methyl)carbamate

Sources & evidence

ORD record
ord-f8bcb796d47d419c97a08dd02ec0c703
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…