3-[(4-phenylphenyl)carbamoyl]thiophene-2-carboxylic Acid

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 3-[(4-phenylphenyl)carbamoyl]thiophene-2-carboxylic Acid
• 化学式: C₁₈H₁₃NO₃S
• 分子量: 323.372
• InChiKey: VONKGJIOTKVJFW-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：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  94.6
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  3-噻吩甲酰氯 在 正丁基锂 作用下， 生成 3-[(4-phenylphenyl)carbamoyl]thiophene-2-carboxylic Acid
  参考文献：
  名称：

  Biphenyl-4-ylcarbamoyl thiophene carboxylic acids as potent DHODH inhibitors

  摘要：

  A previously discovered DHODH inhibitor series was further improved by replacing the cyclopentene ring by aromatic heterocycles. Different isomers of these compounds were prepared by the directed ortho-metallation procedure. The compounds are more active than the corresponding cyclopentene analogs and show potent effects on PBMC's proliferation. (c) 2005 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2005.10.011

文献信息

• [EN] AROMATIC COMPOUNDS AS ANTI-INFLAMMATORY, IMMUNOMODULATORY AND ANTI-PROLIFERATORY AGENTS<br/>[FR] AROMATIC COMPOUNDS AS ANTI-INFLAMMATORY, IMMUNOMODULATORY AND ANTI-PROLIFERATORY AGENTS
  申请人：4SC AG

  公开号：WO2004056797A1

  公开（公告）日：2004-07-08

  The present invention relates to compounds of the general formula (II) and salts and physiologically functional derivatives thereof, for the use as a medicament.

  本发明涉及通式（II）化合物及其盐和生理功能衍生物，用于作为药物。
• Novel compounds as anti-inflammatory, immunomodulatory and anti-proliferatory agents
  申请人：4SC AG

  公开号：US20040192758A1

  公开（公告）日：2004-09-30

  The present invention relates to compounds of the general formula (II) and salts and physiologically functional derivatives thereof, 1 for the use as a medicament.

  本发明涉及通式（II）化合物及其盐类和生理功能衍生物、 1 用作药物。
• AROMATIC COMPOUNDS AS ANTI-INFLAMMATORY, IMMUNOMODULATORY AND ANTI-PROLIFERATORY AGENTS
  申请人：4SC AG

  公开号：EP1578741A1

  公开（公告）日：2005-09-28
• DHODH-INHIBITORS AND METHOD FOR THEIR IDENTIFICATION
  申请人：4SC AG

  公开号：EP1581478A1

  公开（公告）日：2005-10-05
• AMINO-BENZOIC ACID DERIVATIVES FOR USE IN THE TREATMENT OF DIHYDROGENASE-RELATED DISORDERS
  申请人：SANOFI

  公开号：EP2493468A1

  公开（公告）日：2012-09-05