Hydrochloric Acid → N,N-dimethyl-1-((9-methyl-2-(2-methyl-1H-benzo[d]imidazol-1-yl)-6-morpholino-9H-purin-8-yl)methyl)azetidine-3-carboxamide

HRID 2323415Notes

Reaction equation

HRID 2323415 reaction equation
[C:39]([O:40][BH-:41]([O:42][C:43](=[O:44])[CH3:45])[O:46][C:47](=[O:48])[CH3:49])(=[O:50])[CH3:51].[CH3:1][n:2]1[c:3]2[n:4][c:5](-[n:19]3[c:20]([CH3:28])[n:21][c:22]4[c:23]3[cH:24][cH:25][cH:26][cH:27]4)[n:6][c:7]([N:13]3[CH2:14][CH2:15][O:16][CH2:17][CH2:18]3)[c:8]2[n:9][c:10]1[CH:11]=[O:12].[CH3:30][N:31]([C:32](=[O:33])[CH:34]1[CH2:35][NH:36][CH2:37]1)[CH3:38].[ClH:29].[Na+:52]>>[CH3:1][n:2]1[c:3]2[n:4][c:5](-[n:19]3[c:20]([CH3:28])[n:21][c:22]4[c:23]3[cH:24][cH:25][cH:26][cH:27]4)[n:6][c:7]([N:13]3[CH2:14][CH2:15][O:16][CH2:17][CH2:18]3)[c:8]2[n:9][c:10]1[CH2:11][N:36]1[CH2:35][CH:34]([C:32]([N:31]([CH3:30])[CH3:38])=[O:33])[CH2:37]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 923Sodium ionHCID 2724942TriacetoxyborohydrideHCID 53308703N,N-Dimethyl-3-azetidinecarboxamideHCID 596054202-(2-methylbenzoimidazol-1-yl)-9-methyl-6-morpholin-4-yl-9H-purine-8-carbaldehyde

Product 1

HCID 59606049N,N-dimethyl-1-((9-methyl-2-(2-methyl-1H-benzo[d]imidazol-1-yl)-6-morpholino-9H-purin-8-yl)methyl)azetidine-3-carboxamide

Sources & evidence

ORD record
ord-803ba61516fa4f69930f73d4351e6965
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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