Hydrochloric Acid → 7-[2-Amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-N-[4-(1H-pyrazol-1-yl)phenyl]-3,4-dihydroisoquinoline-2(1H)-carboxamide

HRID 298667Notes

Reaction equation

HRID 298667 reaction equation
[CH3:17][N:18]1[CH2:19][CH2:20][N:21]([c:24]2[n:25][c:26]([NH2:40])[n:27][c:28](-[c:30]3[cH:31][cH:32][c:33]4[c:38]([cH:39]3)[CH2:37][NH:36][CH2:35][CH2:34]4)[cH:29]2)[CH2:22][CH2:23]1.[Cl:13][C:14]([Cl:15])=[O:16].[ClH:41].[n:1]1(-[c:6]2[cH:7][cH:8][c:9]([NH2:10])[cH:11][cH:12]2)[n:2][cH:3][cH:4][cH:5]1>>[n:1]1(-[c:6]2[cH:7][cH:8][c:9]([NH:10][C:14](=[O:16])[N:36]3[CH2:35][CH2:34][c:33]4[cH:32][cH:31][c:30](-[c:28]5[n:27][c:26]([NH2:40])[n:25][c:24]([N:21]6[CH2:20][CH2:19][N:18]([CH3:17])[CH2:23][CH2:22]6)[cH:29]5)[cH:39][c:38]4[CH2:37]3)[cH:11][cH:12]2)[n:2][cH:3][cH:4][cH:5]1

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 6371PhosgeneHCID 5942744-(1H-Pyrazol-1-yl)anilineHCID 497794384-(4-Methylpiperazin-1-yl)-6-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrimidin-2-amine

Product 1

HCID 594967137-[2-Amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-N-[4-(1H-pyrazol-1-yl)phenyl]-3,4-dihydroisoquinoline-2(1H)-carboxamide

Sources & evidence

ORD record
ord-67440a245aff4c71a777da0604e42e60
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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