3,5-Difluoromandelic acid → 2-[2-(3,5-Difluoro-Phenyl)-2-hydroxy-acetylamino]-pentanoic acid [1-(1,1-dimethyl-2-pyrrolidin-1-yl-ethyl)-1H-imidazol-4-yl]-amide

HRID 114065Notes

Reaction equation

HRID 114065 reaction equation
[CH3:1][C:2]([CH2:3][N:4]1[CH2:5][CH2:6][CH2:7][CH2:8]1)([CH3:9])[n:10]1[cH:11][n:12][c:13]([NH:15][C:16]([CH:17]([CH2:18][CH2:19][CH3:20])[NH2:21])=[O:22])[cH:14]1.[F:23][c:24]1[cH:25][c:26]([CH:31]([C:32](=[O:33])[OH:34])[OH:35])[cH:27][c:28]([F:30])[cH:29]1>>[CH3:1][C:2]([CH2:3][N:4]1[CH2:5][CH2:6][CH2:7][CH2:8]1)([CH3:9])[n:10]1[cH:11][n:12][c:13]([NH:15][C:16]([CH:17]([CH2:18][CH2:19][CH3:20])[NH:21][C:32]([CH:31]([c:26]2[cH:25][c:24]([F:23])[cH:29][c:28]([F:30])[cH:27]2)[OH:35])=[O:33])=[O:22])[cH:14]1

Participants

3

Reactant 2

HCID 5886483,5-Difluoromandelic acidHCID 671642262-Amino-pentanoic acid [1-(1,1-dimethyl-2-pyrrolidin-1-yl-ethyl)-1H-imidazol-4-yl]-amide

Product 1

HCID 117126602-[2-(3,5-Difluoro-Phenyl)-2-hydroxy-acetylamino]-pentanoic acid [1-(1,1-dimethyl-2-pyrrolidin-1-yl-ethyl)-1H-imidazol-4-yl]-amide

Sources & evidence

ORD record
ord-37e9ab0cf8ac4b5eace17c09719d88a1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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