Methanol → 7-Methoxy-4-((6-(6-(piperazin-1-yl)pyridin-3-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methoxy)quinoline

HRID 183521Notes

Reaction equation

HRID 183521 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]2[c:7]([O:13][CH2:14][c:15]3[n:16][n:17][c:18]4[n:19]3[n:20][c:21](-[c:24]3[cH:25][cH:26][c:27]([N:30]5[CH2:31][CH2:32][N:33]([C:36]([O:37][C:38]([CH3:39])([CH3:40])[CH3:41])=[O:42])[CH2:34][CH2:35]5)[n:28][cH:29]3)[cH:22][cH:23]4)[cH:8][cH:9][n:10][c:11]2[cH:12]1.[CH3:56][OH:57].[CH3:58][C:59]#[N:60].[Cl:50][CH2:51][Cl:52].[Cl:53][CH2:54][Cl:55].[F:43][C:44]([F:45])([F:46])[C:47]([OH:48])=[O:49]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]2[c:7]([O:13][CH2:14][c:15]3[n:16][n:17][c:18]4[n:19]3[n:20][c:21](-[c:24]3[cH:25][cH:26][c:27]([N:30]5[CH2:31][CH2:32][NH:33][CH2:34][CH2:35]5)[n:28][cH:29]3)[cH:22][cH:23]4)[cH:8][cH:9][n:10][c:11]2[cH:12]1

Participants

6

Reactant 5

HCID 887MethanolHCID 6342AcetonitrileHCID 6344Dichloromethane2×HCID 6422Trifluoroacetic acidHCID 57691032Tert-butyl 4-(5-(3-((7-methoxyquinolin-4-yloxy)methyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)pyridin-2-yl)piperazine-1-carboxylate

Product 1

HCID 576913597-Methoxy-4-((6-(6-(piperazin-1-yl)pyridin-3-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methoxy)quinoline

Sources & evidence

ORD record
ord-c7c2853769b642c5b1310776c1264732
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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