Water → (2-Chloro-9-cyclopentyl-purin-6-yl)-{2-[3-(4-methyl-piperazin-1-yl)-propoxy]-phenyl}-amine

HRID 2332355Notes

Reaction equation

HRID 2332355 reaction equation
[CH3:28][N:29]1[CH2:30][CH2:31][NH:32][CH2:33][CH2:34]1.[Cl:1][CH2:2][CH2:3][CH2:4][O:5][c:6]1[c:7]([NH:12][c:13]2[c:14]3[n:15][cH:16][n:17]([CH:23]4[CH2:24][CH2:25][CH2:26][CH2:27]4)[c:18]3[n:19][c:20]([Cl:22])[n:21]2)[cH:8][cH:9][cH:10][cH:11]1.[OH2:35]>>[CH2:2]([CH2:3][CH2:4][O:5][c:6]1[c:7]([NH:12][c:13]2[c:14]3[n:15][cH:16][n:17]([CH:23]4[CH2:24][CH2:25][CH2:26][CH2:27]4)[c:18]3[n:19][c:20]([Cl:22])[n:21]2)[cH:8][cH:9][cH:10][cH:11]1)[N:32]1[CH2:31][CH2:30][N:29]([CH3:28])[CH2:34][CH2:33]1

Participants

4

Reactant 3

HCID 962WaterHCID 531671-MethylpiperazineHCID 11774121HCID 11774121, compound

Product 1

HCID 11784673(2-Chloro-9-cyclopentyl-purin-6-yl)-{2-[3-(4-methyl-piperazin-1-yl)-propoxy]-phenyl}-amine

Sources & evidence

ORD record
ord-cbda60550a8b460b9fc674fd86275f97
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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