Trifluoroacetic acid → HCID 22346447, compound

HRID 2160489Notes

Reaction equation

HRID 2160489 reaction equation
[Br:1][c:2]1[c:3]2[cH:4][cH:5][cH:6][n:7][c:8]2[c:9]([OH:23])[c:10]([C:12](=[O:13])[NH:14][CH2:15][c:16]2[cH:17][cH:18][c:19]([F:22])[cH:20][cH:21]2)[n:11]1.[CH3:24][N:25]1[C:26](=[O:31])[CH2:27][NH:28][CH2:29][CH2:30]1.[CH3:48][N:49]1[CH2:50][CH2:51][CH2:52][N:53]([CH3:54])[C:55]1=[O:56].[CH:32]([N:33]([CH:34]([CH3:35])[CH3:36])[CH2:37][CH3:38])([CH3:39])[CH3:40].[F:41][C:42]([F:43])([F:44])[C:45]([OH:46])=[O:47]>>[c:2]1([N:28]2[CH2:27][C:26](=[O:31])[N:25]([CH3:24])[CH2:30][CH2:29]2)[c:3]2[cH:4][cH:5][cH:6][n:7][c:8]2[c:9]([OH:23])[c:10]([C:12](=[O:13])[NH:14][CH2:15][c:16]2[cH:17][cH:18][c:19]([F:22])[cH:20][cH:21]2)[n:11]1

Participants

6

Reactant 5

HCID 6422Trifluoroacetic acidHCID 81531DiisopropylethylamineHCID 816462(1H)-Pyrimidinone, tetrahydro-1,3-dimethyl-HCID 43990421-Methylpiperazin-2-oneHCID 223464015-bromo-N-(4-fluorobenzyl)-8-hydroxy-1,6-naphthyridine-7-carboxamide

Product 1

HCID 22346447HCID 22346447, compound

Sources & evidence

ORD record
ord-150d3863a5c242c1a91276eb30519118
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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