Bicarbonate Ion → HCID 22318672, compound

HRID 126426Notes

Reaction equation

HRID 126426 reaction equation
[C:39](=[O:40])([OH:41])[O-:42].[CH3:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1.[F:17][c:18]1[cH:19][cH:20][c:21]([CH:24]([CH2:25][N:26]2[CH2:27][CH2:28][NH:29][CH2:30][CH2:31]2)[N:32]2[CH2:33][CH2:34][N:35]([CH3:38])[CH2:36][CH2:37]2)[cH:22][cH:23]1.[Na+:43].[c:1]1([CH2:11][CH2:12][CH2:13][C:14](=[O:15])[Cl:16])[cH:2][cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12>>[c:1]1([CH2:11][CH2:12][CH2:13][C:14](=[O:15])[N:29]2[CH2:28][CH2:27][N:26]([CH2:25][CH:24]([c:21]3[cH:20][cH:19][c:18]([F:17])[cH:23][cH:22]3)[N:32]3[CH2:33][CH2:34][N:35]([CH3:38])[CH2:36][CH2:37]3)[CH2:31][CH2:30]2)[cH:2][cH:3][cH:4][c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]12

Participants

6

Reactant 5

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 1140TolueneHCID 10957750Piperazine, 1-[1-(4-fluorophenyl)-2-(1-piperazinyl)ethyl]-4-methyl-HCID 22318647HCID 22318647, compound

Product 1

HCID 22318672HCID 22318672, compound

Sources & evidence

ORD record
ord-3a7993443a80450181d662993145bcf5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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