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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2423165Generated: November 2, 2026

Trifluoroacetic acid → HCID 67242915, compound

https://huagongshe.com/reaction/2423165

Reaction equation

Participants

RoleNameHCIDCharge
ReactantTrifluoroacetic acidHCID 6422—
ReactantSodium hydrideHCID 24758—
Reactant3-Cyanobenzene-1-sulfonyl chlorideHCID 2801360—
ReactantHCID 69036330HCID 69036330—
SolventDimethylformamideHCID 6228—
ProductHCID 67242915HCID 67242915—

Reaction Conditions

Temperature50 °C

Reaction Steps

tert-Butyl 10-chloro-1,3,4,8-tetrahydro-2H-[1,4]oxazepino[6,7-e]indole-2-carboxylate (Intermediate 20, 10 mg, 0.031 mmol) was dissolved in DMF (1 mL) and sodium hydride (60% in mineral oil, 2.5 mg, 0.062 mmol) was added. The mixture was stirred for 10 minutes at room temperature before 3-cyanobenzene-1-sulfonyl chloride (13 mg, 0.062 mmol) was added. The reaction mixture was stirred for 20 minutes before TFA (2 mL) was added and the mixture was heated at 50° C. overnight. The reaction mixture was evaporated and the crude material was purified by preparative HPLC (ACE C8, 0.1% TFA-CH3CN) to give the title compound as an off-white solid (1.3 mg) in the form of the trifluoroacetate salt. MS m/z 388 [M+H]+.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07960374B2
Source datasetuspto-grants-2011_06
ORD IDord-99f6e0b629604157842ed095d63b8d7f
Source noteuspto-grants-2011_06