Hydrochloric Acid → Benzenamine,4-[(6-chloro-1h-pyrrolo[2,3-b]pyridin-4-yl)oxy]-3,5-difluoro-

HRID 214798Notes

Reaction equation

HRID 214798 reaction equation
[C:14](=[O:15])([O-:16])[O-:17].[CH3:39][S:40]([CH3:41])=[O:42].[CH3:43][CH2:44][O:45][C:46](=[O:47])[CH3:48].[Cl:1][c:2]1[cH:3][c:4]([N+:11]([O-:12])=[O:13])[c:5]2[c:6]([n:7]1)[nH:8][cH:9][cH:10]2.[ClH:28].[K+:18].[K+:19].[NH2:29][c:30]1[cH:31][c:32]([F:38])[c:33]([OH:37])[c:34]([F:36])[cH:35]1.[Na+:26].[Na+:27].[S:20]([S:21]([O-:22])=[O:23])([O-:24])=[O:25]>>[Cl:1][c:2]1[cH:3][c:4]([O:37][c:33]2[c:32]([F:38])[cH:31][c:30]([NH2:29])[cH:35][c:34]2[F:36])[c:5]2[c:6]([n:7]1)[nH:8][cH:9][cH:10]2

Participants

10

Reactant 9

HCID 313Hydrochloric AcidHCID 679Dimethyl SulfoxideHCID 813Potassium Cation2×HCID 923Sodium ion2×HCID 1086DithioniteHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 27787644-Amino-2,6-difluorophenolHCID 179793386-chloro-4-nitro-1H-pyrrolo[2,3-b]pyridine

Product 1

HCID 17979280Benzenamine,4-[(6-chloro-1h-pyrrolo[2,3-b]pyridin-4-yl)oxy]-3,5-difluoro-

Sources & evidence

ORD record
ord-2a69b4009fca43e282b9592e9196bcb4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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