当前位置: 首页 » 资料 » 化学物质数据库 » STK141565,ZINC00977624,AM-879/40742582, 3,5-dimethoxy-N-(naphthalen-1-

STK141565,ZINC00977624,AM-879/40742582, 3,5-dimethoxy-N-(naphthalen-1-

放大字体  缩小字体 更新日期:2018-05-08  浏览次数:1
摘 要:STK141565,ZINC00977624,AM-879/40742582, 3,5-dimethoxy-N-(naphthalen-1-ylcarbamothioyl)benzamide,Canonical SMILES: COC1=CC(=CC(=C1)C(=O)NC(=S)NC2=CC=CC3=CC=CC=C32)OC,InChI: InChI=1/C20H18N2O3S/c1-24-15-10-14(11-16(12-15)25-2)19(23)22-20(26)21-,18-9-5-
[Synonyms]
STK141565
ZINC00977624
AM-879/40742582

[Structure]
STK141565,ZINC00977624,AM-879/40742582, 3,5-dimethoxy-N-(naphthalen-1-

[ Properties Computed from Structure]
Molecular Weight366.43352 [g/mol]
Molecular FormulaC20H18N2O3S
XLogP4.3
H-Bond Donor2
H-Bond Acceptor3
Rotatable Bond Count4
Tautomer Count5
Exact Mass366.103813
MonoIsotopic Mass366.103813
Topological Polar Surface Area59.6
Heavy Atom Count26
Formal Charge0
Complexity489
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: 3,5-dimethoxy-N-(naphthalen-1-ylcarbamothioyl)benzamide
Canonical SMILES: COC1=CC(=CC(=C1)C(=O)NC(=S)NC2=CC=CC3=CC=CC=C32)OC
InChI: InChI=1/C20H18N2O3S/c1-24-15-10-14(11-16(12-15)25-2)19(23)22-20(26)21-
18-9-5-7-13-6-3-4-8-17(13)18/h3-12H,1-2H3,(H2,21,22,23,26)/f/h21-22H

 
本文导航:
  • (1) STK141565,ZINC00977624,AM-879/40742582, 3,5-dimethoxy-N-(naphthalen-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