N'-[4-(6-methoxy-4-piperazin-1-yl-2-naphthyl)pyrimidin-2-yl]-N,N-dimethylpropane-1,3-diamine → N1-(4-(4-(4-(3-bromo-1H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl)-6-methoxynaphthalen-2-yl)pyrimidin-2-yl)-N3,N3-dimethylpropane-1,3-diamine

HRID 102565Notes

Reaction equation

HRID 102565 reaction equation
[Br:32][c:33]1[n:34][nH:35][c:36]2[n:37][cH:38][n:39][c:40]([Cl:42])[c:41]12.[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([N:26]3[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]3)[cH:7][c:8](-[c:13]3[n:14][c:15]([NH:19][CH2:20][CH2:21][CH2:22][N:23]([CH3:24])[CH3:25])[n:16][cH:17][cH:18]3)[cH:9][c:10]2[cH:11][cH:12]1>>[CH3:1][O:2][c:3]1[cH:4][c:5]2[c:6]([N:26]3[CH2:27][CH2:28][N:29]([c:40]4[n:39][cH:38][n:37][c:36]5[nH:35][n:34][c:33]([Br:32])[c:41]54)[CH2:30][CH2:31]3)[cH:7][c:8](-[c:13]3[n:14][c:15]([NH:19][CH2:20][CH2:21][CH2:22][N:23]([CH3:24])[CH3:25])[n:16][cH:17][cH:18]3)[cH:9][c:10]2[cH:11][cH:12]1

Participants

3

Reactant 2

HCID 53257826N'-[4-(6-methoxy-4-piperazin-1-yl-2-naphthyl)pyrimidin-2-yl]-N,N-dimethylpropane-1,3-diamineHCID 1784783943-Bromo-4-chloro-1H-pyrazolo[3,4-d]pyrimidine

Product 1

HCID 178487401N1-(4-(4-(4-(3-bromo-1H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl)-6-methoxynaphthalen-2-yl)pyrimidin-2-yl)-N3,N3-dimethylpropane-1,3-diamine

Sources & evidence

ORD record
ord-1c1bc6d319364d5c9e370d76f1122296
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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