当前位置: 首页 » 资料 » 化学物质数据库 » STK184192,ZINC00882163,BAS 02820678,AG-690/15430785,1-(2-Methyl-benzoy

STK184192,ZINC00882163,BAS 02820678,AG-690/15430785,1-(2-Methyl-benzoy

放大字体  缩小字体 更新日期:2018-05-08  浏览次数:2
摘 要:STK184192,ZINC00882163,BAS 02820678,AG-690/15430785,1-(2-Methyl-benzoyl)-3-(2-methyl-5-oxazolo[4,5-b]pyridin-2-yl-phenyl)-thiourea, 2-methyl-N-[[2-methyl-5-([1,3]oxazolo[4,,5-b]pyridin-2-yl)phenyl]carbamothioyl]benzamide,Canonical SMILES: CC1=C(C=C(C
[Synonyms]
STK184192
ZINC00882163
BAS 02820678
AG-690/15430785
1-(2-Methyl-benzoyl)-3-(2-methyl-5-oxazolo[4,5-b]pyridin-2-yl-phenyl)-thiourea

[Structure]
STK184192,ZINC00882163,BAS 02820678,AG-690/15430785,1-(2-Methyl-benzoy

[ Properties Computed from Structure]
Molecular Weight402.46892 [g/mol]
Molecular FormulaC22H18N4O2S
XLogP4.5
H-Bond Donor2
H-Bond Acceptor4
Rotatable Bond Count3
Tautomer Count5
Exact Mass402.115047
MonoIsotopic Mass402.115047
Topological Polar Surface Area80.1
Heavy Atom Count29
Formal Charge0
Complexity603
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-methyl-N-[[2-methyl-5-([1,3]oxazolo[4,
5-b]pyridin-2-yl)phenyl]carbamothioyl]benzamide
Canonical SMILES: CC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC=N3)NC(=S)NC(=O)C4=CC=CC=C4C
InChI: InChI=1/C22H18N4O2S/c1-13-6-3-4-7-16(13)20(27)26-22(29)24-17-12-15(10-9-
14(17)2)21-25-19-18(28-21)8-5-11-23-19/h3-12H,1-2H3,(H2,24,26,27,
29)/f/h24,26H

 
本文导航:
  • (1) STK184192,ZINC00882163,BAS 02820678,AG-690/15430785,1-(2-Methyl-benzoy
  • 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