N-(3-acyloxy-2-benzylpropyl)-N'-[4-(methylsulfonylamino)benzyl]thiourea analogues: novel potent and high affinity antagonists and partial antagonists of the vanilloid receptor

J Med Chem. 2003 Jul 3;46(14):3116-26. doi: 10.1021/jm030089u.

Abstract

Isosteric replacement of the phenolic hydroxyl group in potent vanilloid receptor (VR1) agonists with the alkylsulfonamido group provides a series of compounds which are effective antagonists to the action of the capsaicin on rat VR1 heterologously expressed in Chinese hamster ovary (CHO) cells. In particular, compound 61, N-[2-(3,4-dimethylbenzyl)-3-pivaloyloxypropyl]-N'-[3-fluoro-4-(methylsulfonylamino)benzyl]thiourea was a full antagonist against capsaicin, displayed a K(i) value of 7.8 nM (compared to 520 nM for capsazepine and 4 nM for 5-iodoRTX), and showed excellent analgesic activity in mice. Structure-activity analysis of the influence of modifications in the A- and C-regions of 4-methylsulfonamide ligands on VR1 agonism/antagonism indicated that 3-fluoro substitution in the A-region and a 4-tert-butylbenzyl moiety in the C-region favored antagonism, whereas a 3-methoxy group in the A-region and 3-acyloxy-2-benzylpropyl moieties in the C-region favored agonism.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Analgesics / chemical synthesis*
  • Analgesics / chemistry
  • Analgesics / pharmacology
  • Animals
  • CHO Cells
  • Calcium / metabolism
  • Capsaicin / pharmacology
  • Cricetinae
  • Ligands
  • Male
  • Mice
  • Mice, Inbred ICR
  • Rats
  • Receptors, Drug / agonists
  • Receptors, Drug / antagonists & inhibitors*
  • Structure-Activity Relationship
  • Sulfonamides / chemical synthesis*
  • Sulfonamides / chemistry
  • Sulfonamides / pharmacology
  • Thiourea / analogs & derivatives
  • Thiourea / chemical synthesis*
  • Thiourea / chemistry
  • Thiourea / pharmacology

Substances

  • Analgesics
  • Ligands
  • N-(2-(3,4-dimethylbenzyl)-3-pivaloyloxypropyl)-N'-(3-fluoro-4-(methylsulfonylamino)benzyl)thiourea
  • Receptors, Drug
  • Sulfonamides
  • Thiourea
  • Capsaicin
  • Calcium