tert-butyl (2,3-dihydro-1,4-benzodioxin-6-ylmethyl)(1-(2-(2-oxopyrido(2,3-b)pyrazin-1(2H)-yl)ethyl)piperidin-4-yl)carbamate | 959614-25-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 咪唑并吡啶类
• 英文名称: tert-butyl (2,3-dihydro-1,4-benzodioxin-6-ylmethyl)(1-(2-(2-oxopyrido(2,3-b)pyrazin-1(2H)-yl)ethyl)piperidin-4-yl)carbamate
• 英文别名: tert-butyl N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-[1-[2-(2-oxopyrido[2,3-b]pyrazin-1-yl)ethyl]piperidin-4-yl]carbamate
• CAS: 959614-25-6
• 化学式: C₂₈H₃₅N₅O₅
• 分子量: 521.616
• InChiKey: LVLLPIBZDADWCC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  38
• 可旋转键数：
  8
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  96.8
• 氢给体数：
  0
• 氢受体数：
  8

文献信息

• NOVEL HETEROCYCLIC COMPOUND OR SALT THEREOF AND INTERMEDIATE THEREOF
  申请人：KIYOTO Taro

  公开号：US20120226035A1

  公开（公告）日：2012-09-06

  Disclosed is a compound represented by the general formula: wherein R 1 represents an aryl or heterocyclic group which may be substituted or the like; X 1 represents a C 2 -C 4 alkylene group or the like; X 2 , X 3 and X 5 independently represent NH, a bond or the like; X 4 represents a lower alkylene group, a bond or the like; Y 1 represents a bivalent alicyclic hydrocarbon residue which may be substituted or a bivalent alicyclic amine residue which may be substituted; and Z 1 , Z 2 , Z 3 , Z 4 , Z 5 and Z 6 independently represent a nitrogen atom, a group represented by the formula: CH, or the like, provided that at least one of Z 3 , Z 4 , Z 5 and Z 6 represents a nitrogen atom, or a salt thereof, which is useful as an antibacterial agent.

  本发明公开了一种化合物，其通式表示为：其中R1表示取代的芳基或杂环基等；X1表示C2-C4烷基或类似基团；X2、X3和X5独立地表示NH、键或类似基团；X4表示低级烷基基团、键或类似基团；Y1表示可以取代的二价脂环烃残基或可以取代的二价脂环胺残基；Z1、Z2、Z3、Z4、Z5和Z6独立地表示氮原子、由公式CH表示的基团或类似基团，其中至少有一个Z3、Z4、Z5和Z6表示氮原子，或其盐，其作为抗菌剂有用。
• US8211908B2
  申请人：——

  公开号：US8211908B2

  公开（公告）日：2012-07-03
• US8367831B2
  申请人：——

  公开号：US8367831B2

  公开（公告）日：2013-02-05