3-(4-ethoxyphenyl)-2-thioxo-2,3-dihydro-4(1H)-quinazolinone 3-(4-乙氧基苯基)-2-硫烷基-3,4-二氢喹唑啉-4-酮

CAS 1035-51-4 MFCD01238589

化学结构图

1035-51-4
SMILES: CCOc1ccc(-n2c(=S)[nH]c3ccccc3c2=O)cc1

化学属性

Mol. FormulaC16H14N2O2S
Mol. Weight298.36
Melting Point>250 °C

别名和识别编码

Chemical Name3-(4-Ethoxyphenyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
CAS Number1035-51-4
Alfabeta NameETHOXYPHENYLTHIOXODIHYDROQUINAZOLINONE H3422341(())--------,
MDL NumberMFCD01238589
Chemical Name Translation3-(4-乙氧基苯基)-2-硫烷基-3,4-二氢喹唑啉-4-酮
LabNetwork Molecule IDLN00149312
PubChem Substance ID831534
InChIInChI=1S/C16H14N2O2S/c1-2-20-12-9-7-11(8-10-12)18-15(19)13-5-3-4-6-14(13)17-16(18)21/h3-10H,2H2,1H3,(H,17,21)
Synonym 3-(4-Ethoxyphenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one {LY} 3-(4-Ethoxyphenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one {} {LY} 3-(4-Ethoxyphenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one {} {} {LY} 3-(4-Ethoxyphenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one {} {} {} {LY} 3-(4-Ethoxyphenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one {} {} {} {} {LY} 3-(4-Ethoxyphenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one {} {} {} {} {} {LY} 3-(4-Ethoxyphenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one {} {} {} {} {} {} {LY} 3-(4-Ethoxyphenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one {} {} {} {} {} {} {} {LY} 3-(4-Ethoxyphenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one {} {} {} {} {} {} {} {} {LY} 3-(4-Ethoxyphenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one {} {} {} {} {} {} {} {} {} {LY} 3-(4-Ethoxyphenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one {} {} {} {} {} {} {} {} {} {} {LY} 3-(4-Ethoxyphenyl)-2-sulfanyl-3,4-dihydroquinazolin-4-one {} {} {} {} {} {} {} {} {} {} {} {LY} 3-(4-Ethoxyphenyl)-2-sulfan
Canonical SMILESCCOC1=CC=C(N2C(C3=CC=CC=C3NC2=S)=O)C=C1
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分类

  • {KO} Misc
  • {KO} AminesSecondaryHeteroNH

安全信息

Warnings IRRITANT
Storage condition

药物吸收、分布、代谢与排泄(ADME)

Lipinski's Rule of 5
Y
H-bond Donors
1
H-bond Acceptors
3
Rotatable Bonds
3
LogP
3

系列性分类


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