Methanol → HCID 178463231, compound

HRID 139826Notes

Reaction equation

[CH3:38][OH:39].[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:40]([Cl:41])([Cl:42])[Cl:43].[Cl:44][CH2:45][Cl:46].[O:32]=[C:33]1[CH2:34][CH2:35][CH2:36][CH2:37]1>>[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]3[CH2:34][CH2:35][CH2:36][CH2:37]3)[CH2:6]1)[CH2:7]2

Participants

Reactant 5

HCID 887Methanol

HCID 6212Chloroform

HCID 6344Dichloromethane

HCID 8452Cyclopentanone

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 178463231HCID 178463231, compound

Sources & evidence

ORD record: ord-e611f1d5df254f9b977a8b3db81ef57a
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

Reaction notes

Loading…