4-Chlorophenylboronic acid → 4-[5-(4-Chlorophenyl)pyridin-2-yl]piperazine-1-carboxylic acid tert-butyl ester

HRID 1115591Notes

Reaction equation

HRID 1115591 reaction equation
[C:1]([O:2][C:3]([N:4]1[CH2:5][CH2:6][N:7]([c:8]2[n:9][cH:10][c:11](-[c:12]3[cH:13][cH:14][c:15]([F:16])[cH:17][cH:18]3)[cH:19][n:20]2)[CH2:21][CH2:22]1)=[O:23])([CH3:24])([CH3:25])[CH3:26].[C:27]([CH3:28])([CH3:29])([CH3:30])[O:31][C:32](=[O:33])[N:34]1[CH2:35][CH2:36][N:37]([c:40]2[n:41][cH:42][c:43]([Br:46])[cH:44][cH:45]2)[CH2:38][CH2:39]1.[Cl:47][c:48]1[cH:49][cH:50][c:51]([B:54]([OH:55])[OH:56])[cH:52][cH:53]1>>[C:27]([CH3:28])([CH3:29])([CH3:30])[O:31][C:32](=[O:33])[N:34]1[CH2:35][CH2:36][N:37]([c:40]2[n:41][cH:42][c:43](-[c:51]3[cH:50][cH:49][c:48]([Cl:47])[cH:53][cH:52]3)[cH:44][cH:45]2)[CH2:38][CH2:39]1

Participants

4

Reactant 3

HCID 742994-Chlorophenylboronic acidHCID 112447754-Boc-1-(5-bromo-2-pyridyl)piperazineHCID 69850026Tert-butyl 4-[5-(4-fluorophenyl)pyrimidin-2-yl]piperazine-1-carboxylate

Product 1

HCID 698953994-[5-(4-Chlorophenyl)pyridin-2-yl]piperazine-1-carboxylic acid tert-butyl ester

Sources & evidence

ORD record
ord-cbf6ad46ed154c9b90d18825a72a4cfd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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