3-(R)-phenyl-3-({5-fluoro-4-[4-(4-acetylphenyl)phenyl]thien-2-yl}carboxamido)-propanoate | 819837-57-5

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 肽模拟物
• 英文名称: 3-(R)-phenyl-3-({5-fluoro-4-[4-(4-acetylphenyl)phenyl]thien-2-yl}carboxamido)-propanoate
• 英文别名: ethyl 3-(R)-phenyl-3-({5-fluoro-4-[4-(4-acetylphenyl)phenyl]thien-2-yl}carboxamido)-propanoate；ethyl (3R)-3-[[4-[4-(4-acetylphenyl)phenyl]-5-fluorothiophene-2-carbonyl]amino]-3-phenylpropanoate
• CAS: 819837-57-5
• 化学式: C₃₀H₂₆FNO₄S
• 分子量: 515.605
• InChiKey: MHFBWPUNELRRSF-AREMUKBSSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.3
• 重原子数：
  37
• 可旋转键数：
  10
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  101
• 氢给体数：
  1
• 氢受体数：
  6

文献信息

• [EN] 5-FLUORO-THIOPEN-COMPOUNDS,THE PROCESS FOR THEIR PREPARATION,THE PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS METALLOPOTENASES INHIBITORS<br/>[FR] COMPOSES 5-FLUORO-THIOPHENE, LEUR PROCEDE DE PREPARATION, COMPOSITIONS PHARMACEUTIQUES LES CONTENANT ET LEURS APPLICATIONS A TITRE D'INHIBITEURS DE METALLOPROTEASES
  申请人：WARNER LAMBERT CO

  公开号：WO2005003114A1

  公开（公告）日：2005-01-13

  Compounds of formula (I) in which R1 represent a group selected from halo(C1-C6)alkoxy, (C1-C6)alkyl, (C1-C6)alkoxy, (C1-C6)alkylthio, phenyl, cyclohexyl and a heterocycle, each of these groups being optionally substituted with one or two groups as defined in the description, R2 represents a group -U-R4 in which U represents a linear (C1-C4)alkylene chain optionally substituted with a group selected from carboxyl, carboxy(C1-C6)alkyl-, (C1-C6)alkyloxycarbonyl and (C 1-C6)alkyloxycarbonyl(C1-C6)alkyl-,o R4 represents a phenyl, cyclohexyl or morpholin-4-yl group, each of these groups being optionally substituted with one or two groups as defined in the description, the optical isomers thereof or the addition salts thereof with a pharmaceutically acceptable acid or base,and pharmaceutical compositions containing them, which are useful for treating pathologies associated with an inhibition of metalloproteases, and more specifically an inhibition of metalloprotease

  化合物(I)的化学式中，R1代表从卤(C1-C6)烷氧基，(C1-C6)烷基，(C1-C6)烷氧基，(C1-C6)烷基硫醚，苯基，环己基和杂环中选择的一个基团，这些基团可以选择性地用定义中的一个或两个基团进行取代，R2代表一个-U-R4基团，其中U代表一个线性的(C1-C4)烷基链，该链可以选择性地用从羧基，羧基(C1-C6)烷基，(C1-C6)烷氧羰基和(C1-C6)烷氧羰基(C1-C6)烷基中选择的一个基团进行取代，R4代表苯基，环己基或吗啡啉-4-基团，这些基团可以选择性地用定义中的一个或两个基团进行取代，它们的光学异构体或与药学上可接受的酸或碱形成的加合物，以及包含它们的制药组合物，这些化合物在治疗与金属蛋白酶抑制有关的病理过程中非常有用，更具体地说是金属蛋白酶抑制。
• Fluorothiophene derivatives, process for preparing them and pharmaceutical compositions containing them
  申请人：Compere Delphine

  公开号：US20050014817A1

  公开（公告）日：2005-01-20

  The invention provides compounds of Formula (I), stereoisomers thereof, or pharmaceutically acceptable salts of said compounds or stereoisomers wherein R1 and R2 are as defined herein as well as compositions comprising the same, processes for making the same, and methods of using the same to treat a variety of diseases, including, those requiring interaction with metalloproteases, and more specifically with macrophage metalloelastase (MMP-12), and for the prevention and treatment of respiratory pathologies such as chronic obstructive bronchopneumopathy (COPD), emphysema, chronic bronchitis, chronic pulmonary inflammation, asthma, cystic fibrosis, acute respiratory distress syndrome (ARDS), respiratory allergies including allergic rhinitis, and also diseases associated with the production of TNFα including severe fibrotic pulmonary disease, pulmonary sarcoidosis and silicosis. The compounds of the present invention also show inhibitory activity on metalloprotease-13 (MMP-13), making them useful for the treatment of pathologies involving this enzyme, such as cancer, osteoporosis, osteoarthritis, arthritis, rheumatoid arthritis, atherosclerosis, multiple sclerosis and cardiac insufficiency.