2-(3-cyano-5-methyl-2-phenyl-4-(2-(phenylsulfonyl)benzyl)-1H-pyrrol-1-yl)acetic acid | 1312717-49-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯
• 英文名称: 2-(3-cyano-5-methyl-2-phenyl-4-(2-(phenylsulfonyl)benzyl)-1H-pyrrol-1-yl)acetic acid
• 英文别名: 2-[3-[[2-(Benzenesulfonyl)phenyl]methyl]-4-cyano-2-methyl-5-phenylpyrrol-1-yl]acetic acid
• CAS: 1312717-49-9
• 化学式: C₂₇H₂₂N₂O₄S
• 分子量: 470.549
• InChiKey: IRHRYFUOGZBRAC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  34
• 可旋转键数：
  7
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  109
• 氢给体数：
  1
• 氢受体数：
  5

文献信息

• CRTH2 MODULATORS
  申请人：MERMERIAN Ara

  公开号：US20110150834A1

  公开（公告）日：2011-06-23

  Modulators of CRTH2, particularly antagonists of CRTH2, that are useful for treating various disorders, including asthma and respiratory disorders are disclosed. The compounds fall within a genus described by formula I:

  CRTH2的调节剂，特别是CRTH2的拮抗剂，可用于治疗各种疾病，包括哮喘和呼吸系统疾病。这些化合物属于由公式I描述的一类物质。
• METHODS OF TREATING ALOPECIA AND ACNE
  申请人：Ironwood Pharmaceuticals, Inc.

  公开号：US20150080381A1

  公开（公告）日：2015-03-19

  Method of treating alopecia and acne with are disclosed. The compounds fall within described by formula I or II:
• US8674115B2
  申请人：——

  公开号：US8674115B2

  公开（公告）日：2014-03-18
• [EN] CRTH2 MODULATORS<br/>[FR] MODULATEURS DU CRTH2
  申请人：IRONWOOD PHARMACEUTICALS INC

  公开号：WO2011079007A1

  公开（公告）日：2011-06-30

  Modulators of CRTH2, particularly antagonists of CRTH2, that are useful for treating various disorders, including asthma and respiratory disorders are disclosed. The compounds fall within a genus described by formula I.