Hydrochloric Acid → HCID 178437410, compound

HRID 1216566Notes

Reaction equation

HRID 1216566 reaction equation
[CH2:1]([CH3:2])[c:3]1[n:4][c:5]2[c:6]([n:7]1-[c:8]1[n:9][c:10]([N:35]3[CH2:36][CH2:37][O:38][CH2:39][CH2:40]3)[c:11]3[n:12][c:13]([CH2:23][N:24]4[CH2:25][CH:26]([N:28]5[CH2:29][C:30](=[O:34])[NH:31][CH2:32][CH2:33]5)[CH2:27]4)[n:14]([CH:17]4[CH2:18][CH2:19][CH2:20][CH2:21][O:22]4)[c:15]3[n:16]1)[cH:41][cH:42][cH:43][cH:44]2.[ClH:45].[O:46]1[CH2:47][CH2:48][O:49][CH2:50][CH2:51]1>>[CH2:1]([CH3:2])[c:3]1[n:4][c:5]2[c:6]([n:7]1-[c:8]1[n:9][c:10]([N:35]3[CH2:36][CH2:37][O:38][CH2:39][CH2:40]3)[c:11]3[n:12][c:13]([CH2:23][N:24]4[CH2:25][CH:26]([N:28]5[CH2:29][C:30](=[O:34])[NH:31][CH2:32][CH2:33]5)[CH2:27]4)[nH:14][c:15]3[n:16]1)[cH:41][cH:42][cH:43][cH:44]2

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 312751,4-DioxaneHCID 596060014-{1-[2-(2-Ethylbenzoimidazol-1-yl)-6-morpholin-4-yl-9-(tetrahydropyran-2-yl)-9H-purin-8-ylmethyl]azetidin-3-yl}piperazin-2-one

Product 1

HCID 178437410HCID 178437410, compound

Sources & evidence

ORD record
ord-9955b7dbcc5647d58320e5a9f1efc3b1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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