Back
HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1171445Generated: November 1, 2026

Hexylamine → 2-(4-{4-[5-(4-tert-Butylphenyl)-4-methyl-4H-[1,2,4]-triazol-3-ylsulfanyl]-2-heptyloxybenzyl amino}phenyl)-N-hexylacetamide

https://huagongshe.com/reaction/1171445

Reaction equation

Participants

RoleNameHCIDCharge
ReactantHexylamineHCID 8102—
Reactant1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 15908—
Reactant1-HydroxybenzotriazoleHCID 75771—
Reactant(4-{4-[5-(4-tert-Butylphenyl)-4-methyl-4H-[1,2,4}-triazol-3-ylsulfanyl]-2-heptyloxybenzylamino}phenyl)acetic acidHCID 11157700—
SolventWaterHCID 962—
SolventDimethylformamideHCID 6228—
Product2-(4-{4-[5-(4-tert-Butylphenyl)-4-methyl-4H-[1,2,4]-triazol-3-ylsulfanyl]-2-heptyloxybenzyl amino}phenyl)-N-hexylacetamideHCID 11158214—

Reaction Steps

A solution of (4-{4-[5-(4-tert-butylphenyl)-4-methyl-4H-[1,2,4]-triazol-3-ylsulfanyl]-2-heptyloxybenzyl amino}phenyl)acetic acid (0.3 g, 0.5 mmol), benzotriazol-1-ol (0.074 g, 0.55 mmol) in dimethylformamide (10 ml) is stirred for 20 minutes. n-Hexylamine (0.066 ml, 0.5 mmol) and (3-dimethylaminopropyl)ethylcarbodiimide (0.105 g, 0.55 mmol) are added and then the medium is stirred for 24 hours at room temperature. The addition of water causes the formation of a precipitate which is dried before being purified by chromatography on a silica column, eluted with a heptane/ethyl acetate (3/7) mixture. After evaporation of the solvents, 0.205 g (60%) of the expected compound is recovered.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07829588B2
Source datasetuspto-grants-2010_11
ORD IDord-9bbac46f9c4f4bd786dc261dcd6e2cb0
Source noteuspto-grants-2010_11