4-(2-Chloroethyl)morpholine → 2-methyl-4-(3-piperazino)propyl-4H-pyrazolo[1,5-a]-pyrazolo[4',3':5,6]pyrido[3,4-e]pyrimidin-5(8H)-one

HRID 99071

Reaction equation

HRID 99071 reaction equation
[CH3:20][c:21]1[n:22][n:23]2[c:24]([nH:25][c:26](=[O:36])[c:27]3[c:28]2[c:29]2[c:30]([n:31][cH:32]3)[nH:33][n:34][cH:35]2)[cH:37]1.[Cl:11][CH2:12][CH2:13][N:14]1[CH2:15][CH2:16][O:17][CH2:18][CH2:19]1.[N:1]1([CH2:7][CH2:8][CH2:9][Cl:10])[CH2:2][CH2:3][NH:4][CH2:5][CH2:6]1>>[N:1]1([CH2:7][CH2:8][CH2:9][n:25]2[c:24]3[n:23]([n:22][c:21]([CH3:20])[cH:37]3)[c:28]3[c:27]([c:26]2=[O:36])[cH:32][n:31][c:30]2[c:29]3[cH:35][n:34][nH:33]2)[CH2:2][CH2:3][NH:4][CH2:5][CH2:6]1

Participants

4

Reactant 3

HCID 767274-(2-Chloroethyl)morpholineHCID 5776061-(3-Chloropropyl)piperazineHCID 1357053822-methyl-4H-pyrazolo[1,5-a]pyrazolo-[4',3':5,6]pyrido[3,4-e]pyrimidin-5(8H)-one

Product 1

HCID 227574922-methyl-4-(3-piperazino)propyl-4H-pyrazolo[1,5-a]-pyrazolo[4',3':5,6]pyrido[3,4-e]pyrimidin-5(8H)-one

Sources & evidence

ORD record
ord-f7c02b0d4ae4464bba79082cf8c191b6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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