Hydrochloric Acid → Tert-butyl 2-(2-((6-chloro-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl)methylamino)pyrimidin-4-yl)pyrrolidine-1-carboxylate

HRID 2343299Notes

Reaction equation

HRID 2343299 reaction equation
[C:40](=[O:41])([O-:42])[O-:43].[CH3:46][C:47]#[N:48].[CH3:49][CH2:50][O:51][C:52](=[O:53])[CH3:54].[Cl:2][c:3]1[cH:4][cH:5][c:6]2[n:7]([cH:8]1)[c:9]([CH2:19][Cl:20])[c:10](-[c:12]1[cH:13][cH:14][c:15]([F:18])[cH:16][cH:17]1)[n:11]2.[ClH:1].[K+:44].[K+:45].[NH2:21][c:22]1[n:23][cH:24][cH:25][c:26]([CH:28]2[N:29]([C:33](=[O:34])[O:35][C:36]([CH3:37])([CH3:38])[CH3:39])[CH2:30][CH2:31][CH2:32]2)[n:27]1>>[Cl:2][c:3]1[cH:4][cH:5][c:6]2[n:7]([cH:8]1)[c:9]([CH2:19][NH:21][c:22]1[n:23][cH:24][cH:25][c:26]([CH:28]3[N:29]([C:33](=[O:34])[O:35][C:36]([CH3:37])([CH3:38])[CH3:39])[CH2:30][CH2:31][CH2:32]3)[n:27]1)[c:10](-[c:12]1[cH:13][cH:14][c:15]([F:18])[cH:16][cH:17]1)[n:11]2

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 813Potassium Cation2×HCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 583369006-Chloro-3-(chloromethyl)-2-(4-fluorophenyl)imidazo[1,2-a]pyridineHCID 58336948Tert-butyl 2-(2-aminopyrimidin-4-yl)pyrrolidine-1-carboxylate

Product 1

HCID 58336929Tert-butyl 2-(2-((6-chloro-2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl)methylamino)pyrimidin-4-yl)pyrrolidine-1-carboxylate

Sources & evidence

ORD record
ord-10338192b5674399a5fb8da0808ee166
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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