Effect of the acyl groups on O-->N acyl migration in the water-soluble prodrugs of HIV-1 protease inhibitor

Bioorg Med Chem Lett. 2003 Aug 18;13(16):2727-30. doi: 10.1016/s0960-894x(03)00576-6.

Abstract

To improve the low water-solubility of HIV-1 protease inhibitors KNI-272, -279 and -727, we previously reported the water-soluble prodrugs of these inhibitors based on O-->N intramolecular acyl migration reaction. These prodrugs were rapidly converted to the corresponding parent drugs under physiological conditions. To understand the steric and electrostatic effects of O-acyl moiety on the migration rate, we examined several types of prodrug. A remarkably slow migration was observed in the benzoyl-type prodrugs, and Hammett plot of migration rate constants of p-substituted benzoyl-type prodrugs gave a linear free energy relationship.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Acylation
  • Benzoates / chemistry
  • Drug Stability
  • HIV Protease Inhibitors / chemical synthesis*
  • HIV Protease Inhibitors / pharmacology
  • HIV-1*
  • Half-Life
  • Humans
  • Hydrogen-Ion Concentration
  • Phenoxyacetates / chemistry
  • Phenylacetates / chemistry
  • Prodrugs / chemical synthesis*
  • Prodrugs / pharmacology
  • Solubility
  • Static Electricity
  • Structure-Activity Relationship
  • Water

Substances

  • Benzoates
  • HIV Protease Inhibitors
  • Phenoxyacetates
  • Phenylacetates
  • Prodrugs
  • Water