Hydrochloric Acid → HCID 23111441, compound

HRID 308958Notes

Reaction equation

HRID 308958 reaction equation
[C:17]([Cl:18])(=[O:19])[CH2:20][CH:21]([CH3:22])[CH3:23].[CH2:24]([c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)[O:31][c:32]1[c:33]([F:44])[cH:34][c:35]([N:38]2[CH2:39][CH2:40][NH:41][CH2:42][CH2:43]2)[cH:36][cH:37]1.[CH2:45]([CH3:46])[N:47]([C:48](=[O:49])[Cl:50])[CH2:51][CH3:52].[CH3:3][O:4][c:5]1[cH:6][cH:7][c:8]([N:9]2[CH2:10][CH2:11][NH:12][CH2:13][CH2:14]2)[cH:15][cH:16]1.[ClH:1].[ClH:2]>>[CH2:24]([c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1)[O:31][c:32]1[c:33]([F:44])[cH:34][c:35]([N:38]2[CH2:39][CH2:40][N:41]([C:48]([N:47]([CH2:45][CH3:46])[CH2:51][CH3:52])=[O:49])[CH2:42][CH2:43]2)[cH:36][cH:37]1

Participants

6

Reactant 5

HCID 313Hydrochloric Acid2×HCID 6916Diethylcarbamoyl chlorideHCID 66054Isovaleryl chlorideHCID 2697221-(4-Methoxyphenyl)piperazineHCID 231114831-(4-Benzyloxy-3-fluorophenyl)piperazine

Product 1

HCID 23111441HCID 23111441, compound

Sources & evidence

ORD record
ord-8c763baedd164deaa3e77824cf038736
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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