(S)-3-(4-aminophenyl)hex-4-ynoic acid | 1445996-40-6

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 苯丙酸
• 英文名称: (S)-3-(4-aminophenyl)hex-4-ynoic acid
• 英文别名: (3S)-3-(4-aminophenyl)hex-4-ynoic acid
• CAS: 1445996-40-6
• 化学式: C₁₂H₁₃NO₂
• 分子量: 203.241
• InChiKey: DTMOAVQDGNVESH-JTQLQIEISA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.6
• 重原子数：
  15
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  63.3
• 氢给体数：
  2
• 氢受体数：
  3

文献信息

• 3-[4-(PHENYLAMINOOXALYLAMINO)PHENYL]HEX-4-YNOIC ACIDS, PROCESS FOR PREPARATION THEREOF AND USE THEREOF AS A MEDICAMENT
  申请人：DEFOSSA Elisabeth

  公开号：US20130172248A1

  公开（公告）日：2013-07-04

  The invention relates to 3-[4-(phenylaminooxalylamino)phenyl]hex-4-ynoic acids, and to physiologically compatible salts thereof. The invention relates to compounds of the formula I in which R1, R2, R3 and R4 are each defined as specified, and to physiologically compatible salts thereof. The compounds are suitable, for example, for treatment of diabetes.

  本发明涉及3-[4-(苯胺羟草酰基氨基)苯基]己-4-炔酸及其生理相容性盐。本发明涉及式I的化合物，其中R1、R2、R3和R4分别按规定定义，并涉及其生理相容性盐。该化合物适用于治疗糖尿病等疾病。
• [EN] 3-[4-(PHENYLAMINOOXALYLAMINO)PHENYL]HEX-4-YNOIC ACIDS, PROCESS FOR PREPARATION THEREOF AND USE THEREOF AS A MEDICAMENT<br/>[FR] ACIDES 3-[4-(PHÉNYLAMINO OXALYL AMINO) PHÉNYL] HEX-4-ÉNOÏQUES, LEUR PROCÉDÉ DE PRÉPARATION ET LEUR UTILISATION COMME MÉDICAMENT
  申请人：SANOFI SA

  公开号：WO2013102626A1

  公开（公告）日：2013-07-11

  The invention relates to 3-[4-(phenylaminooxalylamino)phenyl]hex-4-ynoic acids, and to physiologically compatible salts thereof. The invention relates to compounds of the formula (I) in which R1, R2, R3 and R4 are each defined as specified, and to physiologically compatible salts thereof. The compounds are suitable, for example, for treatment of diabetes.