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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1735569Generated: October 27, 2026

Phosphorus oxychloride → N-[1-(3,5-Dimethoxyphenyl)-1-methylethyl]-3-cyanoandrosta-3,5-diene-17beta-carboxamide

https://huagongshe.com/reaction/1735569

Reaction equation

Participants

RoleNameHCIDCharge
ReactantPhosphorus oxychlorideHCID 24813—
ReactantChloro-N,N-dimethylformiminium chlorideHCID 77311—
Reactant3-Cyanoandrosta-3,5-diene-17beta-carboxylic acidHCID 15380254—
Reactant2-(3,5-Dimethoxyphenyl)propan-2-amineHCID 15754138—
SolventAcetoneHCID 180—
SolventDimethylformamideHCID 6228—
SolventDichloromethaneHCID 6344—
SolventTriethylamineHCID 8471—
SolventEthyl AcetateHCID 8857—
ProductChloro-N,N-dimethylformiminium chlorideHCID 77311—
ProductN-[1-(3,5-Dimethoxyphenyl)-1-methylethyl]-3-cyanoandrosta-3,5-diene-17beta-carboxamideHCID 5700189250%

Reaction Steps

Vilsmeier reagent was prepared from 1.7 ml of dimethylformamide, 1.8 ml of phosphorus oxychloride, and 5 ml of methylene chloride. 0.23 ml of this Vilsmeier reagent was then added to a solution of 100 mg of 3-cyanoandrosta-3,5-diene-17β-carboxylic acid [prepared as described in Example 1(b)] in 2 ml of methylene chloride. The reaction mixture was then stirred at room temperature for 40 minutes, after which a solution of 1-(3,5-dimethoxyphenyl)-1-methylethylamine [prepared as described in Preparation 10(d)] and 70 μl of triethylamine in 2 ml of methylene chloride were added. The reaction mixture was then diluted with ethyl acetate, washed with dilute aqueous hydrochloric acid, with an aqueous solution of sodium chloride, with a 5% w/v aqueous solution of sodium hydrogencarbonate, and with a saturated aqueous solution of sodium chloride, in that order. It was then dried over anhydrous magnesium sulfate, and concentrated by evaporation under reduced pressure. The resulting residue was subjected to silica gel column chromatography and using a gradient elution method, with solutions of from 1 to 4% by volume of acetone in methylene chloride as the eluent, to give 76 mg (yield 50%) of the title compound.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS05536714
Source datasetuspto-grants-1996_07
ORD IDord-8709352ef65941d087f4ee4e4fcc669a
Source noteuspto-grants-1996_07