Trifluoroacetic acid → HCID 22346392, compound

HRID 1236115Notes

Reaction equation

HRID 1236115 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.[CH2:24]1[CH2:25][S:26][CH2:27][CH2:28][NH:29]1.[CH3:46][N:47]1[CH2:48][CH2:49][CH2:50][N:51]([CH3:52])[C:53]1=[O:54].[CH:30]([N:31]([CH:32]([CH3:33])[CH3:34])[CH2:35][CH3:36])([CH3:37])[CH3:38].[F:39][C:40]([F:41])([F:42])[C:43]([OH:44])=[O:45]>>[c:2]1([N:29]2[CH2:24][CH2:25][S:26][CH2:27][CH2:28]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 67164ThiomorpholineHCID 81531DiisopropylethylamineHCID 816462(1H)-Pyrimidinone, tetrahydro-1,3-dimethyl-HCID 223464015-bromo-N-(4-fluorobenzyl)-8-hydroxy-1,6-naphthyridine-7-carboxamide

Product 1

HCID 22346392HCID 22346392, compound

Sources & evidence

ORD record
ord-17e66e8dfd0148c68cfa6bdb17f212e2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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