当前位置: 首页 » 资料 » 化学物质数据库 » 1-(1,3-benzodioxol-4-yl)-N-(5,6-dimethylbenzimidazol-1-yl)methanimine

1-(1,3-benzodioxol-4-yl)-N-(5,6-dimethylbenzimidazol-1-yl)methanimine

放大字体  缩小字体 更新日期:2018-11-26  浏览次数:3
摘 要: 1-(1,3-benzodioxol-4-yl)-N-(5,6-dimethylbenzimidazol-1-yl)methanimine,Canonical SMILES: CC1=CC2=C(C=C1C)N(C=N2)N=CC3=C4C(=CC=C3)OCO4,InChI: InChI=1/C17H15N3O2/c1-11-6-14-15(7-12(11)2)20(9-18-14)19-8-13-4-3-5-16-,17(13)22-10-21-16/h3-9H,10H2,1-2H3,Mo
[Synonyms]

[Structure]
 1-(1,3-benzodioxol-4-yl)-N-(5,6-dimethylbenzimidazol-1-yl)methanimine

[ Properties Computed from Structure]
Molecular Weight293.3199 [g/mol]
Molecular FormulaC17H15N3O2
XLogP3.9
H-Bond Donor0
H-Bond Acceptor5
Rotatable Bond Count2
Exact Mass293.116427
MonoIsotopic Mass293.116427
Topological Polar Surface Area48.6
Heavy Atom Count22
Formal Charge0
Complexity430
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count1
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]
IUPAC Name: 1-(1,3-benzodioxol-4-yl)-N-(5,6-dimethylbenzimidazol-1-yl)methanimine
Canonical SMILES: CC1=CC2=C(C=C1C)N(C=N2)N=CC3=C4C(=CC=C3)OCO4
InChI: InChI=1/C17H15N3O2/c1-11-6-14-15(7-12(11)2)20(9-18-14)19-8-13-4-3-5-16-
17(13)22-10-21-16/h3-9H,10H2,1-2H3

 
本文导航:
  • (1) 1-(1,3-benzodioxol-4-yl)-N-(5,6-dimethylbenzimidazol-1-yl)methanimine
  • 下一篇:鳖甲
  • 上一篇:暂无
 
[ 资料搜索 ]  [ 加入收藏 ]  [ 告诉好友 ]  [ 打印本文 ]  [ 关闭窗口 ]

 

 
推荐图文
推荐资料
热门关注