Hydrochloric Acid → 4-Chloro-6-(4-cyclobutylpiperazin-1-yl)pyrimidine

HRID 682502Notes

Reaction equation

HRID 682502 reaction equation
[CH2:13]([N:14]([CH:15]([CH3:16])[CH3:17])[CH:18]([CH3:19])[CH3:20])[CH3:21].[CH3:30][CH2:31][O:32][C:33](=[O:34])[CH3:35].[CH:3]1([N:7]2[CH2:8][CH2:9][NH:10][CH2:11][CH2:12]2)[CH2:4][CH2:5][CH2:6]1.[Cl:22][c:23]1[n:24][cH:25][n:26][c:27]([Cl:29])[cH:28]1.[ClH:1].[ClH:2].[OH2:36]>>[CH:3]1([N:7]2[CH2:8][CH2:9][N:10]([c:27]3[n:26][cH:25][n:24][c:23]([Cl:22])[cH:28]3)[CH2:11][CH2:12]2)[CH2:4][CH2:5][CH2:6]1

Participants

7

Reactant 6

HCID 313Hydrochloric Acid2×HCID 962WaterHCID 8857Ethyl AcetateHCID 709434,6-DichloropyrimidineHCID 81531DiisopropylethylamineHCID 47386021-Cyclobutylpiperazine

Product 1

HCID 579250694-Chloro-6-(4-cyclobutylpiperazin-1-yl)pyrimidine

Sources & evidence

ORD record
ord-a48dac3011484dbfafe8c7ae46ee6352
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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