Sodium ion → (4-chloro-1-phenyl-1H-pyrazolo[3,4-b]pyridin-5-yl)(phenyl)methanone

HRID 165704Notes

Reaction equation

HRID 165704 reaction equation
[Na+:31].[OH-:30].[OH:1][c:2]1[c:3]2[c:4]([n:5][cH:6][c:7]1[C:8](=[O:9])[c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1)[n:16](-[c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)[n:17][cH:18]2.[P:25]([Cl:26])([Cl:27])([Cl:28])=[O:29]>>[c:2]1([Cl:27])[c:3]2[c:4]([n:5][cH:6][c:7]1[C:8](=[O:9])[c:10]1[cH:11][cH:12][cH:13][cH:14][cH:15]1)[n:16](-[c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)[n:17][cH:18]2

Participants

5

Reactant 4

HCID 923Sodium ionHCID 961HydroxideHCID 24813Phosphorus oxychlorideHCID 178519487(4-hydroxy-1-phenyl-1H-pyrazolo[3,4-b]pyridin-5-yl)(phenyl)methanone

Product 1

HCID 67005674(4-chloro-1-phenyl-1H-pyrazolo[3,4-b]pyridin-5-yl)(phenyl)methanone

Sources & evidence

ORD record
ord-29b00ba1be5a4cee8cf238cba6bb5b86
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

Loading…