Acetone → HCID 72817346, compound

HRID 1239700Notes

Reaction equation

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

Participants

Reactant 5

HCID 180Acetone

HCID 887Methanol

HCID 6212Chloroform

HCID 6344Dichloromethane

HCID 68905806{4-[5-(2,5-Diaza-bicyclo[2.2.1]hept-2-yl)-imidazo[1,2-c]pyrimidin-7-yl]-pyridin-2-yl}-(1-phenyl-ethyl)-amine

Product 1

HCID 72817346HCID 72817346, compound

Sources & evidence

ORD record: ord-087ba550c2564b92b6e192d4d7fe6604
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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