Trifluoroacetic acid → HCID 46832858, compound

HRID 528786Notes

Reaction equation

HRID 528786 reaction equation
C(OC([N:8]1[CH2:39][CH2:38][C:12]2=[C:13]([N:20]3[CH2:23][CH:22]([C:24](=[O:37])[NH:25][CH:26]4[CH2:31][CH2:30][N:29]([CH2:32][CH:33]=[C:34]([CH3:36])[CH3:35])[CH2:28][CH2:27]4)[CH2:21]3)[N:14]3[C:18]([N:19]=[C:11]2[CH2:10][CH2:9]1)=[CH:17][CH:16]=[N:15]3)=O)(C)(C)C.C(O)(C(F)(F)F)=O>C(Cl)Cl>[CH3:35][C:34]([CH3:36])=[CH:33][CH2:32][N:29]1[CH2:30][CH2:31][CH:26]([NH:25][C:24]([CH:22]2[CH2:23][N:20]([C:13]3[N:14]4[C:18]([N:19]=[C:11]5[CH2:10][CH2:9][NH:8][CH2:39][CH2:38][C:12]=35)=[CH:17][CH:16]=[N:15]4)[CH2:21]2)=[O:37])[CH2:27][CH2:28]1

Participants

4

Reactant 2

HCID 6422Trifluoroacetic acidHCID 67979422HCID 67979422, compound

Product 1

HCID 46832858HCID 46832858, compound

Reagents, catalysts & solvents 1

HCID 6344DichloromethaneSolvent

Procedure

To 70 mg (0.13 mmol) 10-{3-[1-(3-Methyl-but-2-enyl)-piperidin-4-ylcarbamoyl]-azetidin-1-yl}-5,6,8,9-tetrahydro-1,4,7,10a-tetraaza-cyclohept[f]indene-7-carboxylic acid tert-butyl ester in 2 mL of DCM was added 0.13 mL TFA and stirring was continued for 2.5 h at room temperature. The reaction mixture was concentrated and the residue, after addition of small amounts of 1N NaOH and MeOH, purified by HPLC.

Workup

  1. concentrationThe reaction mixture was concentrated
  2. additionthe residue, after addition of small amounts of 1N NaOH and MeOH
  3. custompurified by HPLC

Sources & evidence

ORD record
ord-aef8eac28b2d4653988216c96a18fc65
Source dataset
uspto-grants-2016_05
Patent number
US09346816B2

Reaction notes

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