当前位置: 首页 » 资料 » 化学物质数据库 » STOCK5S-38461,ZINC02218757,BAS 12298276,5-(2-Cyclopentyl-ethyl)-3-(4-m

STOCK5S-38461,ZINC02218757,BAS 12298276,5-(2-Cyclopentyl-ethyl)-3-(4-m

放大字体  缩小字体 更新日期:2018-11-22  浏览次数:0
摘 要:STOCK5S-38461,ZINC02218757,BAS 12298276,5-(2-Cyclopentyl-ethyl)-3-(4-methoxy-phenyl)-[1,2,4]oxadiazole, 5-(2-cyclopentylethyl)-3-(4-methoxyphenyl)-1,2,4-oxadiazole,Canonical SMILES: COC1=CC=C(C=C1)C2=NOC(=N2)CCC3CCCC3,InChI: InChI=1/C16H20N2O2/c1-19-
[Synonyms]
STOCK5S-38461
ZINC02218757
BAS 12298276
5-(2-Cyclopentyl-ethyl)-3-(4-methoxy-phenyl)-[1,2,4]oxadiazole

[Structure]
STOCK5S-38461,ZINC02218757,BAS 12298276,5-(2-Cyclopentyl-ethyl)-3-(4-m

[ Properties Computed from Structure]
Molecular Weight272.3422 [g/mol]
Molecular FormulaC16H20N2O2
XLogP5
H-Bond Donor0
H-Bond Acceptor4
Rotatable Bond Count5
Tautomer Count3
Exact Mass272.152478
MonoIsotopic Mass272.152478
Topological Polar Surface Area48.2
Heavy Atom Count20
Formal Charge0
Complexity286
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: 5-(2-cyclopentylethyl)-3-(4-methoxyphenyl)-1,2,4-oxadiazole
Canonical SMILES: COC1=CC=C(C=C1)C2=NOC(=N2)CCC3CCCC3
InChI: InChI=1/C16H20N2O2/c1-19-14-9-7-13(8-10-14)16-17-15(20-18-16)11-6-12-4-
2-3-5-12/h7-10,12H,2-6,11H2,1H3

 
本文导航:
  • (1) STOCK5S-38461,ZINC02218757,BAS 12298276,5-(2-Cyclopentyl-ethyl)-3-(4-m
  • 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