Dimethylformamide → HCID 68558287, compound

Participants

Role	Name	HCID	Charge
Reactant	Dimethylformamide	HCID 6228	—
Reactant	4-Chlorobenzoic Acid	HCID 6318	—
Reactant	Diphenylacetic Acid	HCID 8333	—
Reactant	Diisopropylethylamine	HCID 81531	—
Reactant	Trifluoroacetate	HCID 84468	—
Reactant	Methanaminium, N-((dimethylamino)(3H-1,2,3-triazolo(4,5-b)pyridin-3-yloxy)methylene)-N-methyl-, hexafluorophosphate(1-) (1:1)	HCID 9886157	—
Product	HCID 68558287	HCID 68558287	—

Reaction Steps

The title compound is prepared essentially as described in Example 39 using a mixture of (3R,4R; 3S,4S)-4-[4-(2-trifluoromethyl-phenyl)-piperazin-1-yl]-pyrrolidin-3-ol bistrifluoroacetate (27 mg, 0.05 mmol) and 4-chloro-benzoic acid (7.8 mg, 0.05 mmol), instead of diphenyl acetic acid, preactivated by addition of a solution of HATU in DMF (0.1 mL, 0.05 mmol, 0.5 M), followed by the addition of a solution of DIPEA in DMF (0.1 mL, 0.05 mmol, 1.5 M), to yield 0.9 mg of the title compound as the trifluoroacetate salt. ESIMS ([M+H]+): 454.1 (100).

Provenance & Evidence

DOI	10.6084/m9.figshare.5104873.v1
Patent number	US07635698B2
Source dataset	uspto-grants-2009_12
ORD ID	ord-6f2c73c31e694bebb98c21553e4fa118
Source note	uspto-grants-2009_12