Hydrochloric Acid → HCID 49779770, compound

HRID 2322089Notes

Reaction equation

HRID 2322089 reaction equation
[CH3:11][N:12]1[CH2:13][CH2:14][N:15]([c:18]2[n:19][c:20]([NH2:34])[n:21][c:22](-[c:24]3[cH:25][cH:26][c:27]4[c:32]([cH:33]3)[CH2:31][NH:30][CH2:29][CH2:28]4)[cH:23]2)[CH2:16][CH2:17]1.[ClH:35].[F:1][c:2]1[c:3]([N:8]=[C:9]=[O:10])[cH:4][cH:5][cH:6][cH:7]1>>[F:1][c:2]1[c:3]([NH:8][C:9](=[O:10])[N:30]2[CH2:29][CH2:28][c:27]3[cH:26][cH:25][c:24](-[c:22]4[n:21][c:20]([NH2:34])[n:19][c:18]([N:15]5[CH2:14][CH2:13][N:12]([CH3:11])[CH2:17][CH2:16]5)[cH:23]4)[cH:33][c:32]3[CH2:31]2)[cH:4][cH:5][cH:6][cH:7]1

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 855882-Fluorophenyl isocyanateHCID 497794384-(4-Methylpiperazin-1-yl)-6-(1,2,3,4-tetrahydroisoquinolin-7-yl)pyrimidin-2-amine

Product 1

HCID 49779770HCID 49779770, compound

Sources & evidence

ORD record
ord-87ba076ce8bc47f2a4d2926a173a2586
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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