Potassium Cation → 4-[(1,4-Dibenzylpiperazin-2-yl)methyl]-3-propan-2-ylpiperazin-2-one

HRID 1212886Notes

Reaction equation

HRID 1212886 reaction equation
[C:37](=[O:38])([O-:39])[O-:40].[CH3:1][S:2]([O:3][CH2:6][CH:7]1[N:8]([CH2:20][c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[CH2:9][CH2:10][N:11]([CH2:13][c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[CH2:12]1)(=[O:4])=[O:5].[CH3:43][C:44]#[N:45].[CH3:46][CH2:47][O:48][C:49]([CH3:50])=[O:51].[CH:27]([CH3:28])([CH3:29])[CH:30]1[C:31](=[O:36])[NH:32][CH2:33][CH2:34][NH:35]1.[K+:41].[K+:42]>>[CH2:6]([CH:7]1[N:8]([CH2:20][c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[CH2:9][CH2:10][N:11]([CH2:13][c:14]2[cH:15][cH:16][cH:17][cH:18][cH:19]2)[CH2:12]1)[N:35]1[CH:30]([CH:27]([CH3:28])[CH3:29])[C:31](=[O:36])[NH:32][CH2:33][CH2:34]1

Participants

7

Reactant 6

HCID 813Potassium Cation2×HCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 448908153-(Propan-2-yl)piperazin-2-oneHCID 123305283(1,4-Dibenzylpiperazin-2-yl)methyl methanesulfonate

Product 1

HCID 771486604-[(1,4-Dibenzylpiperazin-2-yl)methyl]-3-propan-2-ylpiperazin-2-one

Sources & evidence

ORD record
ord-f873d5f486744f18a4a5ab966ad3b18a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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