Hydrochloric Acid → Hydrochloric Acid

HRID 1539040Notes

Reaction equation

HRID 1539040 reaction equation
[CH3:29][N:30]([c:31]1[cH:32][cH:33][c:34]([B:37]([OH:38])[OH:39])[cH:35][cH:36]1)[CH3:40].[ClH:7].[N:8]12[CH2:9][CH:10]([NH:16][C:17](=[O:18])[c:19]3[s:20][c:21]4[c:22]([cH:23]3)[cH:24][cH:25][cH:26][c:27]4[Br:28])[CH:11]([CH2:12][CH2:13]1)[CH2:14][CH2:15]2.[Na+:1].[Na+:2].[Na+:42].[O-:3][C:4](=[O:5])[O-:6].[O:43]=[CH:44][N:45]([CH3:46])[CH3:47].[OH-:41]>>[ClH:7].[N:8]12[CH2:9][CH:10]([NH:16][C:17](=[O:18])[c:19]3[s:20][c:21]4[c:22]([cH:23]3)[cH:24][cH:25][cH:26][c:27]4-[c:34]3[cH:33][cH:32][c:31]([N:30]([CH3:29])[CH3:40])[cH:36][cH:35]3)[CH:11]([CH2:12][CH2:13]1)[CH2:14][CH2:15]2

Participants

9

Reactant 7

HCID 313Hydrochloric AcidHCID 923Sodium ion3×HCID 961HydroxideHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 27343444-(Dimethylamino)phenylboronic acidHCID 17982630N-(1-azabicyclo[2.2.2]octan-3-yl)-7-bromo-1-benzothiophene-2-carboxamide

Product 2

HCID 313Hydrochloric AcidHCID 17982861HCID 17982861, compound

Sources & evidence

ORD record
ord-c3fc19cc5fbc4df0a76c7e66ac3910fe
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

Loading…