2-(2H-1,3-benzodioxol-5-yl)propan-2-amine | 556053-68-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并间二氧杂环戊烯类
• 英文名称: 2-(2H-1,3-benzodioxol-5-yl)propan-2-amine
• 英文别名: 2-(1,3-benzodioxol-5-yl)propan-2-amine
• CAS: 556053-68-0
• 化学式: C₁₀H₁₃NO₂
• mdl: MFCD12774773
• 分子量: 179.22
• InChiKey: JQMKHUHIDJZOLW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.4
• 重原子数：
  13
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  44.5
• 氢给体数：
  1
• 氢受体数：
  3

文献信息

• Heterocyclic acridone inhibitors of IMPDH enzyme
  申请人：——

  公开号：US20030181497A1

  公开（公告）日：2003-09-25

  Compounds having the formula (I), 1 wherein R 3 is selected from H, OH and NH 2 ; R 30 is selected from ═O and ═S; W is —C(═O)—, —S(═O)—, or —S(O) 2 —; or W may be —CH 2 — if X is —C(═O)—; X is selected from —CH 2 —, —N(R 4 )—, and —O—, except that when W is —CH 2 —, X is —C(═O)—; Y is a bond or —C(R 40 )(R 45 )—; Q is a linker; Z is optionally substituted alkyl, alkenyl, alkynyl, cycloalkyl, aryl, heteroaryl, or heterocyclyl; and X 1 , X 2 , X 3 , X 4 , X 5 , X 6 , X 7 , X 8 , X 9 , X 10 and X 11 are selected such a tricyclic heteroaryl ring system is formed as further defined in the specification.

  具有式(I)的化合物，其中R3选自H、OH和NH2; R30选自═O和═S; W为—C(═O)—、—S(═O)—或—S(O)2—; 如果X为—C(═O)—，则W可以是—CH2—; X选自— —、—N(R4)—和—O—，但当W为— —时，X为—C(═O)—; Y为键或—C(R40)(R45)—; Q为连接基; Z为可选的取代烷基、烯基、炔基、环烷基、芳基、杂芳基或杂环烷基; X1、X2、X3、X4、X5、X6、X7、X8、X9、X10和X11被选择为形成如规范中进一步定义的三环杂芳基环系统。
• EP1456207A4
  申请人：——

  公开号：EP1456207A4

  公开（公告）日：2005-06-01
• HETEROCYCLIC ACRIDONE INHIBITORS OF IMPDH ENZYME
  申请人：Bristol-Myers Squibb Company

  公开号：EP1456207A2

  公开（公告）日：2004-09-15
• Antiparkinsonian Action of Phenylisopropylamines
  申请人：Caron G. Marc

  公开号：US20070027208A1

  公开（公告）日：2007-02-01

  A method of treating a subject for Parkinson's disease comprises administering said subject a phenylisopropylamine in an amount effective to treat said Parkinson's disease. In some embodiments the method is used to treat at least a motor symptom of Parkinson's disease; in some embodiments the method is used to treat at least a non-motor symptom of Parkinson's disease.
• US3966770A
  申请人：——

  公开号：US3966770A

  公开（公告）日：1976-06-29