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

HRID 1113083Notes

Reaction equation

HRID 1113083 reaction equation
[CH3:34][CH2:35][N:36]([CH2:37][CH3:38])[CH2:39][CH3:40].[CH3:9][N:10]1[CH2:11][CH2:12][N:13]([c:16]2[n:17][c:18]([NH2:32])[n:19][c:20](-[c:22]3[cH:23][cH:24][c:25]4[c:30]([cH:31]3)[CH2:29][NH:28][CH2:27][CH2:26]4)[cH:21]2)[CH2:14][CH2:15]1.[ClH:33].[N:1](=[C:2]=[O:3])[CH:4]1[CH2:5][CH2:6][CH2:7][CH2:8]1.[O:41]1[CH2:42][CH2:43][CH2:44][CH2:45]1>>[NH:1]([C:2](=[O:3])[N:28]1[CH2:27][CH2:26][c:25]2[cH:24][cH:23][c:22](-[c:20]3[n:19][c:18]([NH2:32])[n:17][c:16]([N:13]4[CH2:12][CH2:11][N:10]([CH3:9])[CH2:15][CH2:14]4)[cH:21]3)[cH:31][c:30]2[CH2:29]1)[CH:4]1[CH2:5][CH2:6][CH2:7][CH2:8]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 643500Cyclopentyl IsocyanateHCID 497794384-(4-Methylpiperazin-1-yl)-6-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrimidin-2-amine

Product 1

HCID 497794417-[2-Amino-6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]-N-cyclopentyl-3,4-dihydroisoquinoline-2(1H)-carboxamide

Sources & evidence

ORD record
ord-704cf4e32b5f41f8a4157af5fb2f9a06
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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