Acetic Acid → HCID 54771296, compound

HRID 176798Notes

Reaction equation

HRID 176798 reaction equation
[CH3:29][C:30]([OH:31])=[O:32].[CH3:4][c:5]1[c:6]2[c:7]([c:8]([N:11]3[CH2:12][CH2:13][N:14]([CH2:17][CH2:18][CH:19]4[CH2:20][CH2:21][CH:22]([NH2:25])[CH2:23][CH2:24]4)[CH2:15][CH2:16]3)[n:9][cH:10]1)[cH:26][cH:27][o:28]2.[ClH:1].[ClH:2].[ClH:3]>>[CH3:4][c:5]1[c:6]2[c:7]([c:8]([N:11]3[CH2:12][CH2:13][N:14]([CH2:17][CH2:18][CH:19]4[CH2:20][CH2:21][CH:22]([NH:25][C:30]([CH3:29])=[O:31])[CH2:23][CH2:24]4)[CH2:15][CH2:16]3)[n:9][cH:10]1)[cH:26][cH:27][o:28]2

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 313Hydrochloric Acid3×HCID 671258124-[2-[4-(7-Methylfuro[3,2-c]pyridin-4-yl)piperazin-1-yl]ethyl]cyclohexan-1-amine

Product 1

HCID 54771296HCID 54771296, compound

Sources & evidence

ORD record
ord-ac77c19082b54e9a81f39c7900918a27
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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