Methanol → 2-amino-5-[4-(difluoromethoxy)phenyl]-5-{3-[(ethylamino)-methyl]phenyl}-3-methyl-3,5-dihydro-4H-imidazol-4-one

HRID 171797Notes

Reaction equation

HRID 171797 reaction equation
[BH4-:30].[CH2:34]1[O:35][CH2:36][CH2:37][CH2:38]1.[CH3:27][CH2:28][NH2:29].[CH3:39][OH:40].[NH2:1][C:2]1=[N:6][C:5]([c:7]2[cH:8][cH:9][c:10]([O:13][CH:14]([F:15])[F:16])[cH:11][cH:12]2)([c:17]2[cH:18][c:19]([CH:20]=[O:21])[cH:22][cH:23][cH:24]2)[C:4](=[O:25])[N:3]1[CH3:26].[Na+:31].[Na+:33].[OH-:32]>>[NH2:1][C:2]1=[N:6][C:5]([c:7]2[cH:8][cH:9][c:10]([O:13][CH:14]([F:15])[F:16])[cH:11][cH:12]2)([c:17]2[cH:18][c:19]([CH2:20][NH:29][CH2:28][CH3:27])[cH:22][cH:23][cH:24]2)[C:4](=[O:25])[N:3]1[CH3:26]

Participants

8

Reactant 7

HCID 887MethanolHCID 923Sodium ion2×HCID 961HydroxideHCID 6341EthylamineHCID 8028TetrahydrofuranHCID 28123BorohydrideHCID 16113437HCID 16113437, compound

Product 1

HCID 251263162-amino-5-[4-(difluoromethoxy)phenyl]-5-{3-[(ethylamino)-methyl]phenyl}-3-methyl-3,5-dihydro-4H-imidazol-4-one

Sources & evidence

ORD record
ord-5ff73efe3f2f49e182e5a7519367b5a3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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