Hydrochloric Acid → 4-tert-Butyl-N-{3-[8-(4-piperazin-1-yl-phenylamino)-imidazo[1,2-a]pyrazin-6-yl]-phenyl}-benzamide

HRID 702646Notes

Reaction equation

HRID 702646 reaction equation
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[cH:15][cH:16][c:17]([NH:20][c:21]3[c:22]4[n:23]([cH:24][c:25](-[c:27]5[cH:28][c:29]([NH:33][C:34]([c:35]6[cH:36][cH:37][c:38]([C:41]([CH3:42])([CH3:43])[CH3:44])[cH:39][cH:40]6)=[O:45])[cH:30][cH:31][cH:32]5)[n:26]3)[cH:46][cH:47][n:48]4)[cH:18][cH:19]2)[CH2:12][CH2:13]1)([CH3:5])([CH3:6])[CH3:7].[CH3:58][CH2:59][O:60][CH2:61][CH3:62].[ClH:49].[Na+:57].[O:50]1[CH2:51][CH2:52][O:53][CH2:54][CH2:55]1.[OH-:56].[OH2:63]>>[NH:8]1[CH2:9][CH2:10][N:11]([c:14]2[cH:15][cH:16][c:17]([NH:20][c:21]3[c:22]4[n:23]([cH:24][c:25](-[c:27]5[cH:28][c:29]([NH:33][C:34]([c:35]6[cH:36][cH:37][c:38]([C:41]([CH3:42])([CH3:43])[CH3:44])[cH:39][cH:40]6)=[O:45])[cH:30][cH:31][cH:32]5)[n:26]3)[cH:46][cH:47][n:48]4)[cH:18][cH:19]2)[CH2:12][CH2:13]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 3283Diethyl EtherHCID 312751,4-DioxaneHCID 597547134-(4-{6-[3-(4-tert-Butyl-benzoylamino)-phenyl]-imidazo[1,2-a]pyrazin-8-ylamino}-phenyl)-piperazine-1-carboxylic Acid Tert-Butyl Ester

Product 1

HCID 115557334-tert-Butyl-N-{3-[8-(4-piperazin-1-yl-phenylamino)-imidazo[1,2-a]pyrazin-6-yl]-phenyl}-benzamide

Sources & evidence

ORD record
ord-5bea45e801f64b778b7b0e4247565b2a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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