Potassium Cation → 1-(3-(4-Chloro-phenyl)-1-[3-[4-(2-fluoro-phenyl)-piperazin-1-yl]-propyl]-1,4,6,7-tetrahydro-pyrazolo[4,3-c]pyridin-5-yl)-ethanone

HRID 1545359Notes

Reaction equation

HRID 1545359 reaction equation
[CH3:43][OH:44].[CH3:45][CH2:46][O:47][C:48]([CH3:49])=[O:50].[CH3:51][C:52]#[N:53].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][n:10]([CH2:20][CH2:21][CH2:22][Cl:23])[c:11]3[c:12]2[CH2:13][N:14]([C:17]([CH3:18])=[O:19])[CH2:15][CH2:16]3)[cH:6][cH:7]1.[F:24][c:25]1[c:26]([N:31]2[CH2:32][CH2:33][NH:34][CH2:35][CH2:36]2)[cH:27][cH:28][cH:29][cH:30]1.[K+:37].[K+:38].[O-:39][C:40]([O-:41])=[O:42]>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[n:9][n:10]([CH2:20][CH2:21][CH2:22][N:34]3[CH2:33][CH2:32][N:31]([c:26]4[c:25]([F:24])[cH:30][cH:29][cH:28][cH:27]4)[CH2:36][CH2:35]3)[c:11]3[c:12]2[CH2:13][N:14]([C:17]([CH3:18])=[O:19])[CH2:15][CH2:16]3)[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 813Potassium Cation2×HCID 887MethanolHCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 705291-(2-Fluorophenyl)piperazineHCID 179754181-[3-(4-Chloro-phenyl)-1-(3-chloro-propyl)-1,4,6,7-tetrahydro-pyrazolo[4,3-c]pyridin-5-yl]-ethanone

Product 1

HCID 102784041-(3-(4-Chloro-phenyl)-1-[3-[4-(2-fluoro-phenyl)-piperazin-1-yl]-propyl]-1,4,6,7-tetrahydro-pyrazolo[4,3-c]pyridin-5-yl)-ethanone

Sources & evidence

ORD record
ord-6c945dc91af6402aa6b9a56eab6e478a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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