Potassium Cation → 5-chloro-2-methylamino-N-[4-(3,3,3-trifluoro-2-hydroxy-propoxy)-benzyl]-N-[2-(3-trifluoromethyl-phenyl)-ethyl]-benzamide

HRID 115730Notes

Reaction equation

HRID 115730 reaction equation
[Br:33][CH2:34][CH:35]([C:36]([F:37])([F:38])[F:39])[OH:40].[C:41](=[O:42])([O-:43])[O-:44].[Cl:1][c:2]1[cH:3][cH:4][c:5]([NH:31][CH3:32])[c:6]([C:7](=[O:8])[N:9]([CH2:10][CH2:11][c:12]2[cH:13][c:14]([C:18]([F:19])([F:20])[F:21])[cH:15][cH:16][cH:17]2)[CH2:22][c:23]2[cH:24][cH:25][c:26]([OH:29])[cH:27][cH:28]2)[cH:30]1.[K+:45].[K+:46].[O:47]=[CH:48][N:49]([CH3:50])[CH3:51].[OH2:52]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([NH:31][CH3:32])[c:6]([C:7](=[O:8])[N:9]([CH2:10][CH2:11][c:12]2[cH:13][c:14]([C:18]([F:19])([F:20])[F:21])[cH:15][cH:16][cH:17]2)[CH2:22][c:23]2[cH:24][cH:25][c:26]([O:29][CH2:34][CH:35]([C:36]([F:37])([F:38])[F:39])[OH:40])[cH:27][cH:28]2)[cH:30]1

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 2206323-Bromo-1,1,1-Trifluoro-2-PropanolHCID 687030505-chloro-N-(4-hydroxy-benzyl)-2-methylamino-N-[2-(3-trifluoromethyl-phenyl)-ethyl]-benzamide

Product 1

HCID 866152415-chloro-2-methylamino-N-[4-(3,3,3-trifluoro-2-hydroxy-propoxy)-benzyl]-N-[2-(3-trifluoromethyl-phenyl)-ethyl]-benzamide

Sources & evidence

ORD record
ord-9a4629d77d854fa2bab0e272e080bb18
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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