Ethanol → 2-chloro-4-(3-iodo-1-(4-methoxybenzyl)-1H-pyrazolo[3,4-b]pyridin-4-yloxy)-5-methylaniline

HRID 315240Notes

Reaction equation

HRID 315240 reaction equation
[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][n:8]2[n:9][c:10]([I:29])[c:11]3[c:12]2[n:13][cH:14][cH:15][c:16]3[O:17][c:18]2[c:19]([CH3:28])[cH:20][c:21]([N+:25]([O-:26])=[O:27])[c:22]([Cl:24])[cH:23]2)[cH:30][cH:31]1.[CH3:37][CH2:38][OH:39].[OH2:32].[OH2:33].[Sn:34]([Cl:35])[Cl:36]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][n:8]2[n:9][c:10]([I:29])[c:11]3[c:12]2[n:13][cH:14][cH:15][c:16]3[O:17][c:18]2[c:19]([CH3:28])[cH:20][c:21]([NH2:25])[c:22]([Cl:24])[cH:23]2)[cH:30][cH:31]1

Participants

5

Reactant 4

HCID 702EthanolHCID 962Water2×HCID 24479Stannous ChlorideHCID 685150271-(4-methoxybenzyl)-4-(5-chloro-2-methyl-4-nitrophenoxy)-3-iodo-1H-pyrazolo[3,4-b]pyridine

Product 1

HCID 685134042-chloro-4-(3-iodo-1-(4-methoxybenzyl)-1H-pyrazolo[3,4-b]pyridin-4-yloxy)-5-methylaniline

Sources & evidence

ORD record
ord-72e188cbcdb04ba8bbbe5a54c28b4215
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…