Hydrochloric Acid → HCID 59321943, compound

HRID 1548569Notes

Reaction equation

[Cl:12][CH2:13][c:14]1[cH:15][cH:16][c:17](-[c:20]2[c:21]([N:26]3[CH2:27][CH2:28][N:29]([CH2:32][c:33]4[cH:34][n:35][n:36]([CH3:39])[c:37]4[CH3:38])[CH2:30][CH2:31]3)[n:22][cH:23][cH:24][n:25]2)[cH:18][cH:19]1.[ClH:10].[ClH:11].[H-:1].[NH:3]1[C:4](=[O:9])[CH2:5][CH2:6][CH2:7][CH2:8]1.[Na+:2].[O:40]=[CH:41][N:42]([CH3:43])[CH3:44]>>[N:3]1([CH2:13][c:14]2[cH:15][cH:16][c:17](-[c:20]3[c:21]([N:26]4[CH2:27][CH2:28][N:29]([CH2:32][c:33]5[cH:34][n:35][n:36]([CH3:39])[c:37]5[CH3:38])[CH2:30][CH2:31]4)[n:22][cH:23][cH:24][n:25]3)[cH:18][cH:19]2)[C:4](=[O:9])[CH2:5][CH2:6][CH2:7][CH2:8]1

Participants

Reactant 6

HCID 313Hydrochloric Acid2×

HCID 923Sodium ion

HCID 6228Dimethylformamide

HCID 126652-Piperidone

HCID 166653Hydride

HCID 685941612-[4-(Chloromethyl)phenyl]-3-[4-[(1,5-dimethylpyrazol-4-yl)methyl]piperazin-1-yl]pyrazine

Product 1

HCID 59321943HCID 59321943, compound

Sources & evidence

ORD record: ord-29dfa471aa73428789a1b74b4021ee67
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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