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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2250805Generated: November 1, 2026

Diisopropylethylamine → Benzyl (2s,3s)-3-hydroxy-2-(2-(2-(3-isopropylureido)-5-(trifluoromethyl)benzamido)acetamido)hex-4-ynylcarbamate

https://huagongshe.com/reaction/2250805

Reaction equation

Participants

RoleNameHCIDCharge
ReactantDiisopropylethylamineHCID 81531—
ReactantBenzotriazol-1-yloxy-tris(dimethylamino)phosphonium hexafluorophosphateHCID 151348—
Reactant2-(2-(3-Ethylureido)-5-(trifluoromethyl)benzamido)acetic acidHCID 21991175—
Reactant(2S,3S)-2-amino-3-hydroxy-hex-4-ynyl-carbamic acid benzyl esterHCID 69196343—
SolventDichloromethaneHCID 6344—
ProductBenzyl (2s,3s)-3-hydroxy-2-(2-(2-(3-isopropylureido)-5-(trifluoromethyl)benzamido)acetamido)hex-4-ynylcarbamateHCID 90910654—

Reaction Steps

A solution of (2S,3S)-[2-(tert-butoxycarbonylamino)-3-hydroxy-hex-4-ynyl]-carbamic acid benzyl ester (0.25 g, prepared as in WO PCT 0250019) in methylene chloride (9 mL) was cooled to 0° C. and charged with trifluoroacetic acid (3 mL). The mixture was allowed to warm to RT and stirred for 45 min before being concentrated in vacuo. The residue was dissolved in methylene chloride and the resultant solution concentrated; this was repeated twice more to afford the TFA salt of (2S,3S)-2-amino-3-hydroxy-hex-4-ynyl-carbamic acid benzyl ester, MS found: (M+H)+=263.3. A solution of this amine in CH2Cl2 (12 mL) was charged successively with N,N-diisopropylethylamine (1.2 mL), 2-(2-(3-ethylureido)-5-(trifluoromethyl)benzamido)acetic acid (240 mg, see WO-02/50019), and BOP (382 mg). The reaction was stirred for 14 h at RT before being partitioned between EtOAc and water. The organic phase was washed with sat. NH4Cl, water, and brine before being dried (Na2SO4), filtered, and concentrated in vacuo. The residue was purified by flash chromatography to afford benzyl (2S,3S)-3-hydroxy-2-(2-(2-(3-isopropylureido)-5-(trifluoromethyl)benzamido)acetamido)hex-4-ynylcarbamate (289 mg). MS found: (M+H)+=592.35.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07317019B2
Source datasetuspto-grants-2008_01
ORD IDord-dc22558e76e34ecbb8fd269f48c2ee47
Source noteuspto-grants-2008_01