Hydrochloric Acid → 3-[4-(2-Hydroxy-1,1-dimethylethyl)phenyl]-5,5-dimethyl-1-{[2-(pyridin-3-ylamino)-pyridin-4-yl]methyl}imidazolidine-2,4-dione

HRID 695872Notes

Reaction equation

HRID 695872 reaction equation
[CH3:1][C:2]1([CH3:35])[N:3]([CH2:21][c:22]2[cH:23][c:24]([NH:28][c:29]3[cH:30][n:31][cH:32][cH:33][cH:34]3)[n:25][cH:26][cH:27]2)[C:4](=[O:20])[N:5]([c:8]2[cH:9][cH:10][c:11]([C:14]([C:15](=[O:16])[OH:17])([CH3:18])[CH3:19])[cH:12][cH:13]2)[C:6]1=[O:7].[CH3:44][OH:45].[CH3:47][CH2:48][O:49][C:50](=[O:51])[CH3:52].[ClH:46].[Na+:38].[O:39]1[CH2:40][CH2:41][CH2:42][CH2:43]1.[OH-:37].[OH2:36]>>[CH3:1][C:2]1([CH3:35])[N:3]([CH2:21][c:22]2[cH:23][c:24]([NH:28][c:29]3[cH:30][n:31][cH:32][cH:33][cH:34]3)[n:25][cH:26][cH:27]2)[C:4](=[O:20])[N:5]([c:8]2[cH:9][cH:10][c:11]([C:14]([CH2:15][OH:16])([CH3:18])[CH3:19])[cH:12][cH:13]2)[C:6]1=[O:7]

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 576259742-(4-{4,4-Dimethyl-2,5-dioxo-3-[2-(pyridin-3-ylamino)pyridin-4-ylmethyl]imidazolidin-1-yl}-phenyl)-2-methylpropionic acid

Product 1

HCID 576260103-[4-(2-Hydroxy-1,1-dimethylethyl)phenyl]-5,5-dimethyl-1-{[2-(pyridin-3-ylamino)-pyridin-4-yl]methyl}imidazolidine-2,4-dione

Sources & evidence

ORD record
ord-3d3ce3d503e54641a28efad16f675ea6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…