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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 374101Generated: October 27, 2026

Sodium Hydroxide → 5-HT3 antagonist 1

https://huagongshe.com/reaction/374101

Reaction equation

Participants

RoleNameHCIDCharge
ReactantSodium HydroxideHCID 14798—
ReactantIndazole-3-carboxylic acidHCID 78250—
Reactant1,3-Propanediamine, N'-(ethylcarbonimidoyl)-N,N-dimethyl-, monohydrochlorideHCID 2723939—
Reactant6-acetylamino-1-(3-methylbenzyl)-4-methylhexahydro-1H-1,4-diazepineHCID 14998991—
SolventHydrochloric AcidHCID 313—
SolventDichloromethaneHCID 6344—
Product5-HT3 antagonist 1HCID 1040725632.4%

Reaction Steps

A solution of 6-acetylamino-1-(3-methylbenzyl)-4-methyl-hexahydro-1H-1,4-diazepine (0.9 g) in 10% hydrochloric acid (20 ml) is refluxed with stirring for 2 hours. After cooling, the reaction mixture is basified with 48% aqueous sodium hydroxide solution and extracted with chloroform. The organic layer is washed with water and dried over magnesium sulfate. The solvent is evaporated under reduced pressure to give an oil. A mixture of this oil, 1H-indazole-3-carboxylic acid (530 mg), 1-ethyl-3-(3-dimethylaminopropyl)carbodiimide hydrochloride (630 mg) and dichloromethane (20 ml) is stirred at 25° C. for 2 hours. The reaction mixture is washed successively with water and 10% aqueous sodium hydroxide solution, dried over magnesium sulfate, and evaporated under reduced pressure. The residue is chromatographed on silica gel with elution of acetone. Fractions containing the title compound are pooled and evaporated under reduced pressure to give the title compound (0.4 g) as an oil.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS05166341
Source datasetuspto-grants-1992_11
ORD IDord-74f6d78a7c7f40ab8d1342a521befe3b
Source noteuspto-grants-1992_11