当前位置: 首页 » 资料 » 化学物质数据库 » ASN 04446089 1-[3-[(2-chlorophenyl)methyl]-4-oxo-2-propylquinazolin-6-

ASN 04446089 1-[3-[(2-chlorophenyl)methyl]-4-oxo-2-propylquinazolin-6-

放大字体  缩小字体 更新日期:2018-05-08  浏览次数:4
摘 要:ASN 04446089 1-[3-[(2-chlorophenyl)methyl]-4-oxo-2-propylquinazolin-6-yl]-3-,phenylurea,Canonical SMILES: CCCC1=NC2=C(C=C(C=C2)NC(=O)NC3=CC=CC=C3)C(=O)N1CC4=CC=CC=C4Cl,InChI: InChI=1/C25H23ClN4O2/c1-2-8-23-29-22-14-13-19(28-25(32)27-18-10-4-3-5-,11-1
[Synonyms]
ASN 04446089
[Structure]
ASN 04446089 1-[3-[(2-chlorophenyl)methyl]-4-oxo-2-propylquinazolin-6-

[ Properties Computed from Structure]
Molecular Weight446.92872 [g/mol]
Molecular FormulaC25H23ClN4O2
XLogP4.7
H-Bond Donor2
H-Bond Acceptor3
Rotatable Bond Count6
Tautomer Count3
Exact Mass446.150954
MonoIsotopic Mass446.150954
Topological Polar Surface Area73.8
Heavy Atom Count32
Formal Charge0
Complexity693
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: 1-[3-[(2-chlorophenyl)methyl]-4-oxo-2-propylquinazolin-6-yl]-3-
phenylurea
Canonical SMILES: CCCC1=NC2=C(C=C(C=C2)NC(=O)NC3=CC=CC=C3)C(=O)N1CC4=CC=CC=C4Cl
InChI: InChI=1/C25H23ClN4O2/c1-2-8-23-29-22-14-13-19(28-25(32)27-18-10-4-3-5-
11-18)15-20(22)24(31)30(23)16-17-9-6-7-12-21(17)26/h3-7,9-15H,2,8,16H2,
1H3,(H2,27,28,32)/f/h27-28H

 
本文导航:
  • (1) ASN 04446089 1-[3-[(2-chlorophenyl)methyl]-4-oxo-2-propylquinazolin-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