当前位置: 首页 » 资料 » 化学物质数据库 » Oprea1_666453,STK253093,ZINC00917824,BAS 03605189,AK-918/40894072,Fura

Oprea1_666453,STK253093,ZINC00917824,BAS 03605189,AK-918/40894072,Fura

放大字体  缩小字体 更新日期:2018-05-08  浏览次数:7
摘 要:Oprea1_666453,STK253093,ZINC00917824,BAS 03605189,AK-918/40894072,Furan-2-carboxylic acid [3-(2,5-dimethoxy-phenylcarbamoyl)-phenyl]-amide, N-[3-[(2,5-dimethoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide,Canonical SMILES: COC1=CC(=C(C=C1)OC)NC(=O)C2=
[Synonyms]
Oprea1_666453
STK253093
ZINC00917824
BAS 03605189
AK-918/40894072
Furan-2-carboxylic acid [3-(2,5-dimethoxy-phenylcarbamoyl)-phenyl]-amide

[Structure]
Oprea1_666453,STK253093,ZINC00917824,BAS 03605189,AK-918/40894072,Fura

[ Properties Computed from Structure]
Molecular Weight366.36732 [g/mol]
Molecular FormulaC20H18N2O5
XLogP2.5
H-Bond Donor2
H-Bond Acceptor5
Rotatable Bond Count6
Tautomer Count4
Exact Mass366.121572
MonoIsotopic Mass366.121572
Topological Polar Surface Area89.8
Heavy Atom Count27
Formal Charge0
Complexity515
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-[3-[(2,5-dimethoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide
Canonical SMILES: COC1=CC(=C(C=C1)OC)NC(=O)C2=CC(=CC=C2)NC(=O)C3=CC=CO3
InChI: InChI=1/C20H18N2O5/c1-25-15-8-9-17(26-2)16(12-15)22-19(23)13-5-3-6-14
(11-13)21-20(24)18-7-4-10-27-18/h3-12H,1-2H3,(H,21,24)(H,22,
23)/f/h21-22H

 
本文导航:
  • (1) Oprea1_666453,STK253093,ZINC00917824,BAS 03605189,AK-918/40894072,Fura
  • 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