Sodium ion → 1-Diphenylmethyl-4-(4'-methylbiphenyl-3-carbonyl)piperazine

HRID 1208366

Reaction equation

HRID 1208366 reaction equation
[CH2:42]([Cl:43])[Cl:44].[CH3:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]([C:14](=[O:15])[OH:16])[cH:11][cH:12][cH:13]2)[cH:6][cH:7]1.[CH3:45][N:46]([CH3:47])[CH:48]=[O:49].[Na+:41].[OH-:40].[S:17]([Cl:18])([Cl:19])=[O:20].[c:21]1([CH:27]([N:28]2[CH2:29][CH2:30][NH:31][CH2:32][CH2:33]2)[c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[cH:22][cH:23][cH:24][cH:25][cH:26]1>>[CH3:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]([C:14](=[O:16])[N:31]3[CH2:30][CH2:29][N:28]([CH:27]([c:21]4[cH:22][cH:23][cH:24][cH:25][cH:26]4)[c:34]4[cH:35][cH:36][cH:37][cH:38][cH:39]4)[CH2:33][CH2:32]3)[cH:11][cH:12][cH:13]2)[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 923Sodium ionHCID 961HydroxideHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 24386Thionyl ChlorideHCID 70048BenzhydrylpiperazineHCID 27739784'-Methyl-biphenyl-3-carboxylic acid

Product 1

HCID 194302781-Diphenylmethyl-4-(4'-methylbiphenyl-3-carbonyl)piperazine

Sources & evidence

ORD record
ord-3c45f26c5a3340f9940ff1d2fce72fab
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Linked notes

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