当前位置: 首页 » 资料 » 化学物质数据库 » Oprea1_067930,Oprea1_787933,ASN 02254695,N-Biphenyl-2-yl-2-(3-cyano-6-

Oprea1_067930,Oprea1_787933,ASN 02254695,N-Biphenyl-2-yl-2-(3-cyano-6-

放大字体  缩小字体 更新日期:2018-05-08  浏览次数:7
摘 要:Oprea1_067930,Oprea1_787933,ASN 02254695,N-Biphenyl-2-yl-2-(3-cyano-6-methoxy-quinolin-2-ylsulfanyl)-acetamide, 2-(3-cyano-6-methoxyquinolin-2-yl)sulfanyl-N-(2-phenylphenyl)acetamide,Canonical SMILES: COC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NC3=CC=CC=C3
[Synonyms]
Oprea1_067930
Oprea1_787933
ASN 02254695
N-Biphenyl-2-yl-2-(3-cyano-6-methoxy-quinolin-2-ylsulfanyl)-acetamide

[Structure]
Oprea1_067930,Oprea1_787933,ASN 02254695,N-Biphenyl-2-yl-2-(3-cyano-6-

[ Properties Computed from Structure]
Molecular Weight425.50226 [g/mol]
Molecular FormulaC25H19N3O2S
XLogP5
H-Bond Donor1
H-Bond Acceptor4
Rotatable Bond Count6
Tautomer Count2
Exact Mass425.119798
MonoIsotopic Mass425.119798
Topological Polar Surface Area75
Heavy Atom Count31
Formal Charge0
Complexity644
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: 2-(3-cyano-6-methoxyquinolin-2-yl)sulfanyl-N-(2-phenylphenyl)acetamide
Canonical SMILES: COC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NC3=CC=CC=C3C4=CC=CC=C4
InChI: InChI=1/C25H19N3O2S/c1-30-20-11-12-22-18(14-20)13-19(15-26)25(28-22)31-
16-24(29)27-23-10-6-5-9-21(23)17-7-3-2-4-8-17/h2-14H,16H2,1H3,(H,27,
29)/f/h27H

 
本文导航:
  • (1) Oprea1_067930,Oprea1_787933,ASN 02254695,N-Biphenyl-2-yl-2-(3-cyano-6-
  • 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