Potassium (4-tert-butoxycarbonylpiperazin-1-yl)methyltrifluoroborate → HCID 178425086, compound

HRID 2017199Notes

Reaction equation

HRID 2017199 reaction equation
[CH3:1][c:2]1[n:30][c:21]([O:22][CH2:23][c:24]2[cH:29][cH:28][cH:27][cH:26][cH:25]2)[c:6]([CH2:7][N:8]3[C:19](=[O:20])[c:18]([c:11]4[CH2:10][CH2:9]3)[c:16]([Cl:17])[c:15](Br)[cH:14][c:12]4[Cl:13])[c:4]([CH3:5])[cH:3]1.[K+].[CH3:31][C:32]([O:35][C:36]([N:38]1[CH2:44][CH2:43][N:41]([CH2:42][B-](F)(F)F)[CH2:40][CH2:39]1)=[O:37])([CH3:34])[CH3:33]>>[CH3:1][c:2]1[n:30][c:21]([O:22][CH2:23][c:24]2[cH:29][cH:28][cH:27][cH:26][cH:25]2)[c:6]([CH2:7][N:8]3[C:19](=[O:20])[c:18]([c:11]4[CH2:10][CH2:9]3)[c:16]([Cl:17])[c:15]([CH2:42][N:41]5[CH2:43][CH2:44][N:38]([C:36]([O:35][C:32]([CH3:34])([CH3:33])[CH3:31])=[O:37])[CH2:39][CH2:40]5)[cH:14][c:12]4[Cl:13])[c:4]([CH3:5])[cH:3]1

Participants

8

Reactant 2

HCID 45588144Potassium (4-tert-butoxycarbonylpiperazin-1-yl)methyltrifluoroborateHCID 867237282-((2-(benzyloxy)-4,6-dimethylpyridin-3-yl)methyl)-7-bromo-5,8-dichloro-3,4-dihydroisoquinolin-1(2H)-one

Product 1

HCID 178425086HCID 178425086, compound

Reagents, catalysts & solvents 5

HCID 962WaterReagentHCID 62657Potassium Phosphate, TribasicReagentHCID 60153068Dichloro-(4,5-bis(diphenylphosphino)-9,9-dimethylxanthene)palladium(II)CatalystHCID 8028TetrahydrofuranSolventHCID 117669-PhenylanthraceneInternal standard

Conditions

Temperature
100 °C

Sources & evidence

ORD record
ord-f1c09443ac63417dbd06142902e04e2f
Source dataset
39k HTE dataset from Pfizer
Original link
View source

Reaction notes

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