4-Fluorobenzylamine → HCID 54711989, compound

HRID 1161909Notes

Reaction equation

HRID 1161909 reaction equation
[C:1]([N:9]1[C:17]2[C:12](=[CH:13][CH:14]=[CH:15][CH:16]=2)[CH2:11][CH:10]1[C:18]1[N:19]([CH3:38])[C:20](=[O:37])[C:21]([O:28]C(=O)C2C=CC=CC=2)=[C:22]([C:24]([O:26]C)=O)[N:23]=1)(=[O:8])[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1.[F:39][C:40]1[CH:47]=[CH:46][C:43]([CH2:44][NH2:45])=[CH:42][CH:41]=1.CC#N.O>CO>[C:1]([N:9]1[C:17]2[C:12](=[CH:13][CH:14]=[CH:15][CH:16]=2)[CH2:11][CH:10]1[C:18]1[N:19]([CH3:38])[C:20](=[O:37])[C:21]([OH:28])=[C:22]([C:24]([NH:45][CH2:44][C:43]2[CH:46]=[CH:47][C:40]([F:39])=[CH:41][CH:42]=2)=[O:26])[N:23]=1)(=[O:8])[C:2]1[CH:7]=[CH:6][CH:5]=[CH:4][CH:3]=1

Participants

5

Reactant 3

HCID 673264-FluorobenzylamineHCID 17961872HCID 17961872, compoundHCID 18373917Acetonitrile--water (1/1)

Product 1

HCID 54711989HCID 54711989, compound

Reagents, catalysts & solvents 1

HCID 887MethanolSolvent

Conditions

Temperature
60 °C

Procedure

The crude product of Step 2 was dissolved in MeOH and 4-fluorobenzylamine (3.5 eq.) added. The solution was stirred at 60° C. over night. The title product was obtained by preparative RP-HPLC (C18, gradient of CH3CN/H2O+0.01% TFA).

Sources & evidence

ORD record
ord-ef034ad1319c4155b4c9031c60e05afb
Source dataset
uspto-grants-2010_10
Patent number
US07820660B2

Reaction notes

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