Hydrochloric Acid → 7-amino-2-methyl-4-(4-propan-2-ylpiperazin-1-yl)-3H-isoindol-1-one

HRID 119151Notes

Reaction equation

HRID 119151 reaction equation
[CH3:27][CH2:28][OH:29].[CH:1]([CH3:2])([CH3:3])[N:4]1[CH2:5][CH2:6][N:7]([c:10]2[c:11]3[c:15]([c:16]([N+:19]([O-:20])=[O:21])[cH:17][cH:18]2)[C:14](=[O:22])[N:13]([CH3:23])[CH2:12]3)[CH2:8][CH2:9]1.[ClH:24].[Fe:30].[Na+:26].[OH-:25]>>[CH:1]([CH3:2])([CH3:3])[N:4]1[CH2:5][CH2:6][N:7]([c:10]2[c:11]3[c:15]([c:16]([NH2:19])[cH:17][cH:18]2)[C:14](=[O:22])[N:13]([CH3:23])[CH2:12]3)[CH2:8][CH2:9]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 23925IronHCID 598492094-(4-Isopropyl-piperazin-1-yl)-2-methyl-7-nitro-2,3-dihydro-isoindol-1-one

Product 1

HCID 598492047-amino-2-methyl-4-(4-propan-2-ylpiperazin-1-yl)-3H-isoindol-1-one

Sources & evidence

ORD record
ord-fcbd3e6da391453d8db71ecafe700229
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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