3-Fluorophenol → HCID 178430350, compound

HRID 306074Notes

Reaction equation

HRID 306074 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([C:8](=[O:9])[N:10]([c:11]2[cH:12][cH:13][c:14]([CH2:17][N:18]3[CH2:19][CH:20]([CH3:31])[N:21]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:22][CH2:23]3)[cH:15][cH:16]2)[CH3:32])[n:6][cH:7]1.[Cu:80][Cl:81].[F:33][c:34]1[cH:35][c:36]([OH:40])[cH:37][cH:38][cH:39]1.[F:41][c:42]1[cH:43][cH:44][c:45]([O:46][c:47]2[cH:48][cH:49][c:50]([C:51]([N:52]([CH3:53])[c:54]3[cH:55][cH:56][c:57]([CH2:58][N:59]4[CH2:60][CH2:61][N:62]([C:63]([O:64][C:65]([CH3:66])([CH3:67])[CH3:68])=[O:69])[CH:70]([CH3:71])[CH2:72]4)[cH:73][cH:74]3)=[O:75])[n:76][cH:77]2)[cH:78][cH:79]1>>[c:2]1([O:40][c:36]2[cH:35][c:34]([F:33])[cH:39][cH:38][cH:37]2)[cH:3][cH:4][c:5]([C:8](=[O:9])[N:10]([c:11]2[cH:12][cH:13][c:14]([CH2:17][N:18]3[CH2:19][CH:20]([CH3:31])[N:21]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:22][CH2:23]3)[cH:15][cH:16]2)[CH3:32])[n:6][cH:7]1

Participants

5

Reactant 4

HCID 97433-FluorophenolHCID 62652Cuprous chlorideHCID 178430327tert-butyl 4-[[4-[(5-bromopyridine-2-carbonyl)-methylamino]phenyl]methyl]-2-methylpiperazine-1-carboxylateHCID 178430352HCID 178430352, compound

Product 1

HCID 178430350HCID 178430350, compound

Sources & evidence

ORD record
ord-b3fce721b2874d86a10b92c629af5b47
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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