当前位置: 首页 » 资料 » 化学物质数据库 » ZINC00937529,A4283/0182662, N-[2-[1-[(4-chlorophenyl)methyl]benzimidaz

ZINC00937529,A4283/0182662, N-[2-[1-[(4-chlorophenyl)methyl]benzimidaz

放大字体  缩小字体 更新日期:2018-05-08  浏览次数:2
摘 要:ZINC00937529,A4283/0182662, N-[2-[1-[(4-chlorophenyl)methyl]benzimidazol-2-yl]ethyl]-2-(phenoxy),acetamide,Canonical SMILES: C1=CC=C(C=C1)OCC(=O)NCCC2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)Cl,InChI: InChI=1/C24H22ClN3O2/c25-19-12-10-18(11-13-19)16-28-22-9-5-4-
[Synonyms]
ZINC00937529
A4283/0182662

[Structure]
ZINC00937529,A4283/0182662, N-[2-[1-[(4-chlorophenyl)methyl]benzimidaz

[ Properties Computed from Structure]
Molecular Weight419.90338 [g/mol]
Molecular FormulaC24H22ClN3O2
XLogP4.9
H-Bond Donor1
H-Bond Acceptor4
Rotatable Bond Count8
Tautomer Count4
Exact Mass419.140055
MonoIsotopic Mass419.140055
Topological Polar Surface Area56.2
Heavy Atom Count30
Formal Charge0
Complexity535
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]
IUPAC Name: N-[2-[1-[(4-chlorophenyl)methyl]benzimidazol-2-yl]ethyl]-2-(phenoxy)
acetamide
Canonical SMILES: C1=CC=C(C=C1)OCC(=O)NCCC2=NC3=CC=CC=C3N2CC4=CC=C(C=C4)Cl
InChI: InChI=1/C24H22ClN3O2/c25-19-12-10-18(11-13-19)16-28-22-9-5-4-8-21(22)27-
23(28)14-15-26-24(29)17-30-20-6-2-1-3-7-20/h1-13H,14-17H2,(H,26,
29)/f/h26H

 
本文导航:
  • (1) ZINC00937529,A4283/0182662, N-[2-[1-[(4-chlorophenyl)methyl]benzimidaz
  • 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