Trifluoroacetic acid → HCID 59304261, compound

HRID 311472Notes

Reaction equation

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

Participants

Reactant 2

HCID 6422Trifluoroacetic acid

HCID 68513921N-(4-(1-(4-methoxybenzyl)-3-(4-(2-methoxyethyl)piperazin-1-yl)-1H-pyrazolo[3,4-b]pyridin-4-yloxy)-3-fluorophenyl)-2-(4-fluorophenyl)-3-oxo-2,3-dihydropyridazine-4-carboxamide

Product 1

HCID 59304261HCID 59304261, compound

Sources & evidence

ORD record: ord-45ab34f1d9e943dfbc2d4edfdb04c0c9
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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