当前位置: 首页 » 资料 » 化学物质数据库 » Oprea1_224860,MLS000535326,SMR000142762,A2574/0109780,5-(4-Ethoxybenzy

Oprea1_224860,MLS000535326,SMR000142762,A2574/0109780,5-(4-Ethoxybenzy

放大字体  缩小字体 更新日期:2018-11-26  浏览次数:6
摘 要:Oprea1_224860,MLS000535326,SMR000142762,A2574/0109780,5-(4-Ethoxybenzyl)-1-(4-ethylphenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione,5-(4-Ethoxy-benzyl)-1-(4-ethyl-phenyl)-pyrimidine-2,4,6(1H,3H,5H)-trione, 5-[(4-ethoxyphenyl)methyl]-1-(4-ethylphenyl)-1,3-dia
[Synonyms]
Oprea1_224860
MLS000535326
SMR000142762
A2574/0109780
5-(4-Ethoxybenzyl)-1-(4-ethylphenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
5-(4-Ethoxy-benzyl)-1-(4-ethyl-phenyl)-pyrimidine-2,4,6(1H,3H,5H)-trione

[Structure]
Oprea1_224860,MLS000535326,SMR000142762,A2574/0109780,5-(4-Ethoxybenzy

[ Properties Computed from Structure]
Molecular Weight366.41038 [g/mol]
Molecular FormulaC21H22N2O4
XLogP3
H-Bond Donor1
H-Bond Acceptor4
Rotatable Bond Count6
Tautomer Count3
Exact Mass366.157957
MonoIsotopic Mass366.157957
Topological Polar Surface Area75.7
Heavy Atom Count27
Formal Charge0
Complexity548
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count1
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]
IUPAC Name: 5-[(4-ethoxyphenyl)methyl]-1-(4-ethylphenyl)-1,3-diazinane-2,4,6-trione
Canonical SMILES: CCC1=CC=C(C=C1)N2C(=O)C(C(=O)NC2=O)CC3=CC=C(C=C3)OCC
InChI: InChI=1/C21H22N2O4/c1-3-14-5-9-16(10-6-14)23-20(25)18(19(24)22-21(23)26)
13-15-7-11-17(12-8-15)27-4-2/h5-12,18H,3-4,13H2,1-2H3,(H,22,24,
26)/f/h22H

 
本文导航:
  • (1) Oprea1_224860,MLS000535326,SMR000142762,A2574/0109780,5-(4-Ethoxybenzy
  • 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