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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1809092Generated: October 30, 2026

Azepane → HCID 42646245, compound

https://huagongshe.com/reaction/1809092

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAzepaneHCID 8119—
ReactantTriethylamineHCID 8471—
ReactantMethanaminium, N-((dimethylamino)(3H-1,2,3-triazolo(4,5-b)pyridin-3-yloxy)methylene)-N-methyl-, hexafluorophosphate(1-) (1:1)HCID 9886157—
Reactant13191-44-1HCID 59542503—
SolventAcetonitrileHCID 6342—
ProductHCID 42646245HCID 4264624553.9%

Reaction Steps

5-(Cyclohexyl)-thiophene-3-carboxylic acid (0.03 g, 0.14 mmol) was dissolved in acetonitrile (2 mL). Triethylamine (0.42 mmol), HATU (0.15 mmol) and azepane (0.14 mmol) were added and the reaction stirred at room temperature overnight. The resulting solution was purified directly by HPLC, eluting with 10%-98% acetonitrile in water (0.1% formic acid) over 30 minutes. The fractions containing the desired product were concentrated under vacuum to give the title compound (0.022 g). LCMS m/z 292.22 [M+H]+ RT=13.57 min (Analytical Method 1). 1H NMR δ (ppm) (CHCl3-d): 7.2 (s, 1H), 6.95 (s, 1H), 3.7-3.4 (m, 4H), 2.8 (m, 1H), 2.1 (m, 2H), 1.9-1.2 (m, 16H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08362008B2
Source datasetuspto-grants-2013_01
ORD IDord-09c0d99a1d314cf49cac836cb38a62e3
Source noteuspto-grants-2013_01