N-(7-hydroxy-1-naphthyl)-N'-[3-(methylsulfanyl)phenyl]urea | 199929-52-7

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: N-(7-hydroxy-1-naphthyl)-N'-[3-(methylsulfanyl)phenyl]urea
• 英文别名: N-(7-hydroxy-1-naphthyl)-N'-[3-(methylthio)phenyl]urea；1-(7-hydroxynaphthalen-1-yl)-3-(3-methylsulfanylphenyl)urea
• CAS: 199929-52-7
• 化学式: C₁₈H₁₆N₂O₂S
• 分子量: 324.403
• InChiKey: GYHZBYPKMNZJKG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  23
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.06
• 拓扑面积：
  86.7
• 氢给体数：
  3
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  1-氨基-7-萘酚 、 3-(甲基硫代)异氰酸苯酯 以 1,4-二氧六环 为溶剂， 反应 3.0h， 生成 N-(7-hydroxy-1-naphthyl)-N'-[3-(methylsulfanyl)phenyl]urea
  参考文献：
  名称：

  Naphthol derivatives as TRPV1 inhibitors for the treatment of urinary incontinence

  摘要：

  We have identified naphthol derivatives as inhibitors of the vanilloid receptor TRPV1 by high throughput screening. The initial lead showed high clearance in rats and has been optimized by enhancing the acidity of the phenol group. Compound 6b has reduced clearance, improved potency and is active in rat cystometry models of urinary incontinence after intravenous administration. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2011.04.013

文献信息

• TREATMENT OF CNIDARIA INTOXICATION
  申请人：Cuypers Eva

  公开号：US20100234454A1

  公开（公告）日：2010-09-16

  The present invention relates to the use of vanilloid receptor (VR) antagonists, and more particularly vanilloid receptor 1 (VR1) antagonist, as analgesics in the treatment and/or prohylaxis of cnidaria envenomations.