Trifluoroacetic acid → HCID 56836193, compound

HRID 928380Notes

Reaction equation

HRID 928380 reaction equation
C(OC(=O)[NH:7][C:8]1[CH:13]=[C:12]([CH3:14])[C:11]([CH2:15][NH:16][C:17]([C:19]2[N:20]=[N:21][N:22]([CH2:24][C:25]3[CH:30]=[CH:29][C:28]([C:31]4[CH:36]=[CH:35][CH:34]=[CH:33][CH:32]=4)=[CH:27][CH:26]=3)[CH:23]=2)=[O:18])=[C:10]([CH3:37])[N:9]=1)(C)(C)C.C(O)(C(F)(F)F)=O>C(Cl)Cl>[NH2:7][C:8]1[N:9]=[C:10]([CH3:37])[C:11]([CH2:15][NH:16][C:17]([C:19]2[N:20]=[N:21][N:22]([CH2:24][C:25]3[CH:30]=[CH:29][C:28]([C:31]4[CH:36]=[CH:35][CH:34]=[CH:33][CH:32]=4)=[CH:27][CH:26]=3)[CH:23]=2)=[O:18])=[C:12]([CH3:14])[CH:13]=1

Participants

4

Reactant 2

HCID 6422Trifluoroacetic acidHCID 58081252HCID 58081252, compound

Product 1

HCID 56836193HCID 56836193, compound

Reagents, catalysts & solvents 1

HCID 6344DichloromethaneSolvent

Procedure

A mixture of (5-{[(1-Biphenyl-4-ylmethyl-1H-[1,2,3]triazole-4-carbonyl)-amino]-methyl}-4,6-dimethyl-pyridin-2-yl)-carbamic acid tert-butyl ester (27 mg, 0.053 mmol), 1 mL TFA and 2 mL DCM was stirred at room temperature for 2 h. The mixture was evaporated in vacuo to yield the final product (TFA salt). 1H-NMR (DMSO-d6, 400 MHz) 13.24 (bs, 1H), 8.87 (t, 1H), 8.70 (s, 1H), 7.65-7.69 (m, 4H), 7.43-7.52 (m, 6H), 7.36-7.40 (t, 1H), 6.62 (s, 1H), 5.70 (s, 2H), 4.43 (d, 2H), 2.52 (s, 3H), 2.40 (s, 3H); LCMS (method A) RtA=1.317 min; [M+H]+=413.0.

Workup

  1. customThe mixture was evaporated in vacuo

Sources & evidence

ORD record
ord-5aa33139a5dd4b31a912399d8269b274
Source dataset
uspto-grants-2016_03
Patent number
US09290485B2

Reaction notes

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