Potassium Cation → 6-Bromo-4-[3-(4-butylpiperidin-1-yl)propyl]-8-fluoro-4H-benzo[1,4]oxazin-3-one

HRID 318694Notes

Reaction equation

HRID 318694 reaction equation
[Br:1][c:2]1[cH:3][c:4]([F:17])[c:5]2[c:6]([cH:16]1)[N:7]([CH2:12][CH2:13][CH2:14][Cl:15])[C:8](=[O:11])[CH2:9][O:10]2.[CH2:26]([CH2:27][CH2:28][CH3:29])[CH:30]1[CH2:31][CH2:32][NH:33][CH2:34][CH2:35]1.[CH3:39][OH:40].[Cl:36][CH2:37][Cl:38].[I-:24].[K+:18].[K+:19].[Na+:25].[O-:20][C:21]([O-:22])=[O:23]>>[Br:1][c:2]1[cH:3][c:4]([F:17])[c:5]2[c:6]([cH:16]1)[N:7]([CH2:12][CH2:13][CH2:14][N:33]1[CH2:32][CH2:31][CH:30]([CH2:26][CH2:27][CH2:28][CH3:29])[CH2:35][CH2:34]1)[C:8](=[O:11])[CH2:9][O:10]2

Participants

9

Reactant 8

HCID 813Potassium Cation2×HCID 887MethanolHCID 923Sodium ionHCID 6344DichloromethaneHCID 19660Carbonate IonHCID 30165Iodide IonHCID 132838674-ButylpiperidineHCID 689111406-Bromo-4-(3-chloropropyl)-8-fluoro-4H-benzo[1,4]oxazin-3-one

Product 1

HCID 102165996-Bromo-4-[3-(4-butylpiperidin-1-yl)propyl]-8-fluoro-4H-benzo[1,4]oxazin-3-one

Sources & evidence

ORD record
ord-3d5419d0d72c48a193ed020dc3eab813
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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