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70638-54-9,MFCD00442728
Catalog No.:AA019OXU

70638-54-9 | 6-(4-Methoxyphenyl)-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
97%
3 weeks  
$233.00   $163.00
- +
100mg
97%
3 weeks  
$290.00   $203.00
- +
250mg
97%
3 weeks  
$368.00   $258.00
- +
500mg
97%
3 weeks  
$599.00   $419.00
- +
1g
97%
3 weeks  
$777.00   $544.00
- +
2.5g
97%
3 weeks  
$1,411.00   $988.00
- +
5g
97%
3 weeks  
$2,034.00   $1,424.00
- +
10g
97%
3 weeks  
$2,959.00   $2,072.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA019OXU
Chemical Name:
6-(4-Methoxyphenyl)-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile
CAS Number:
70638-54-9
Molecular Formula:
C12H9N3O2S
Molecular Weight:
259.2838
MDL Number:
MFCD00442728
SMILES:
COc1ccc(cc1)c1nc(S)[nH]c(=O)c1C#N
Properties
Computed Properties
 
Complexity:
455  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
2  
XLogP3:
1.2  

Downstream Synthesis Route

[1]Nope,Eliana;Sathicq,ÁngelG.;Martínez,JoséJ.;Rojas,Hugo;Romanelli,Gustavo[CatalysisToday,2021,vol.372,p.126-135]

[2]Ram;VandenBerghe;Vlietinck[JournalofHeterocyclicChemistry,1984,vol.21,#5,p.1307-1312]

[3]Locationinpatent:experimentalpartRamiz,MahmoudM.M.;El-Sayed,WaelA.;Hagag,Ezzat;Abdel-Rahman,AdelA.-H.[JournalofHeterocyclicChemistry,2011,vol.48,#5,p.1028-1038]

[4]Ram,VishnuJ.;Berghe,DirkA.Vanden;Vlietinck,ArnoldJ.[LiebigsAnnalenderChemie,1987,p.797-801]

[5]Yan,Gang;Hao,Lina;Niu,Yan;Huang,Wenjie;Wang,Wei;Xu,Fengrong;Liang,Lei;Wang,Chao;Jin,Hongwei;Xu,Ping[EuropeanJournalofMedicinalChemistry,2017,vol.137,p.462-475]

[6]CurrentPatentAssignee:PEKINGUNIVERSITY-CN104860937,2018,BLocationinpatent:Paragraph0145;0146

[7]Locationinpatent:experimentalpartChen,Weixuan;Huang,Ying-ju;Gundala,SushmaReddy;Yang,Hsiuchin;Li,Minyong;Tai,PhangC.;Wang,Binghe[BioorganicandMedicinalChemistry,2010,vol.18,#4,p.1617-1625]

[8]Ram,VishnuJ.;Roy,Raja;Vlietinck,A.J.[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1993,vol.32,#8,p.876-878]

[9]Taher,AzzaTaher;Abou-Seri,SaharMahmoud[Molecules,2012,vol.17,#8,p.9868-9886]Feitosa,SidneyGustavoDiniz;Maciel,LarissaGonçalves;dosAnjos,JanaínaVersiani[JournalofHeterocyclicChemistry,2022]

[10]Stella,Alessandro;VanBelle,Kristien;DeJonghe,Steven;Louat,Thierry;Herman,Jean;Rozenski,Jef;Waer,Mark;Herdewijn,Piet[BioorganicandMedicinalChemistry,2013,vol.21,#5,p.1209-1218]

[11]Basavaraja;Padmashali,Basavaraj;Bhat,K.Ishwar;Hussain,MumtazM.;Vijaykumar[IndianJournalofHeterocyclicChemistry,2011,vol.20,#3,p.241-244]

[12]Galal,ShadiaA.;Khattab,Muhammad;Shouman,SamiaA.;Ramadan,Raghda;Kandil,OmaimaM.;Kandil,OmniaM.;Tabll,Ashraf;ElAbd,YasmineS.;El-Shenawy,Reem;Attia,YasminM.;El-Rashedy,AhmedA.;ElDiwani,HodaI.[EuropeanJournalofMedicinalChemistry,2018,vol.146,p.687-708]

[13]Abdel-Mohsen,HebaT.;Girgis,AdelS.;Mahmoud,AbeerE.E.;Ali,MamdouhM.;ElDiwani,HodaI.[ArchivderPharmazie,2019,vol.352,#11]

[14]Abdel-Aziz,Mohamed;Abdel-Aziz,SalahA.;Abdelrahman,KamalS.;Gouda,AhmedM.;Marzouk,AdelA.;Wanas,AmiraS.;Youssif,BahaaG.M.[BioorganicChemistry,2020,vol.102]

[15]Alfayomy,AbdallahM.;Abdel-Aziz,SalahA.;Marzouk,AdelA.;Shaykoon,MontaserSh.A.;Narumi,Atsushi;Konno,Hiroyuki;Abou-Seri,SaharM.;Ragab,FatmaA.F.[BioorganicChemistry,2021,vol.108]

[16]AbdelGawad,NagwaM.;ElKerdawy,AhmedM.;George,RihamF.;Georgey,HananH.;Mohamed,AbdallaR.[BioorganicChemistry,2021,vol.107]

[17]Cui,Peng-Lei;Zhang,Di;Guo,Xiu-Min;Ji,Shu-Jing;Jiang,Qing-Mei[SyntheticCommunications,2021,vol.51,#11,p.1754-1762]

[18]Chen,Mei;He,Ming;Liu,Tingting;Peng,Feng;Su,Shijun;Tang,Xuemei;Xie,Chengwei;Xue,Wei;Zhan,Wenliang;Zhou,Qing[Chemistryandbiodiversity,2021,vol.18,#8]

3289-75-6    70638-54-9   
N-(4-chlorophenyl)-2-(5-cyano-4-(4-methoxyphenyl)-6-oxo-1,6-dihydropyrimidin-2-ylthio)acetamide 

[1]Mohamed,MohamedM.;Khalil,AliK.;Abbass,EslamM.;El-Naggar,AbeerM.[SyntheticCommunications,2017,vol.47,#16,p.1441-1457]

2632-10-2    70638-54-9   
2‐((2‐(3,4‐dichlorophenyl)‐2‐oxoethyl)thio)‐4‐(4‐methoxyphenyl)‐6‐oxo‐1,6‐dihydropyrimidine‐5‐carbonitrile 

[1]ArchivderPharmazie,2019,vol.352

Literature
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