当前位置: 首页 » 资料 » 化学物质数据库 » Oprea1_021004,Oprea1_072004,ASN 03431467, N-[4-(2,5-dimethoxyphenyl)-1

Oprea1_021004,Oprea1_072004,ASN 03431467, N-[4-(2,5-dimethoxyphenyl)-1

放大字体  缩小字体 更新日期:2018-05-08  浏览次数:15
摘 要:Oprea1_021004,Oprea1_072004,ASN 03431467, N-[4-(2,5-dimethoxyphenyl)-1,,3-thiazol-2-yl]-N-(2-phenylethyl)thiophene-2-carboxamide,Canonical SMILES: COC1=CC(=C(C=C1)OC)C2=CSC(=N2)N(CCC3=CC=CC=C3)C(=O)C4=CC=CS4,InChI: InChI=1/C24H22N2O3S2/c1-28-18-10-11
[Synonyms]
Oprea1_021004
Oprea1_072004
ASN 03431467

[Structure]
Oprea1_021004,Oprea1_072004,ASN 03431467, N-[4-(2,5-dimethoxyphenyl)-1

[ Properties Computed from Structure]
Molecular Weight450.57308 [g/mol]
Molecular FormulaC24H22N2O3S2
XLogP4.7
H-Bond Donor0
H-Bond Acceptor4
Rotatable Bond Count8
Exact Mass450.107184
MonoIsotopic Mass450.107184
Topological Polar Surface Area51.7
Heavy Atom Count31
Formal Charge0
Complexity575
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-[4-(2,5-dimethoxyphenyl)-1,
3-thiazol-2-yl]-N-(2-phenylethyl)thiophene-2-carboxamide
Canonical SMILES: COC1=CC(=C(C=C1)OC)C2=CSC(=N2)N(CCC3=CC=CC=C3)C(=O)C4=CC=CS4
InChI: InChI=1/C24H22N2O3S2/c1-28-18-10-11-21(29-2)19(15-18)20-16-31-24(25-20)
26(23(27)22-9-6-14-30-22)13-12-17-7-4-3-5-8-17/h3-11,14-16H,12-13H2,
1-2H3

 
本文导航:
  • (1) Oprea1_021004,Oprea1_072004,ASN 03431467, N-[4-(2,5-dimethoxyphenyl)-1
  • 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