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207919-03-7,MFCD00041182
Catalog No.:AA002J9O

207919-03-7 | 1-(4-Chloro-3-(trifluoromethyl)phenyl)thiourea

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Purity
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Price(USD)
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100mg
95%
in stock  
$78.00   $55.00
- +
1g
95%
in stock  
$234.00   $164.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002J9O
Chemical Name:
1-(4-Chloro-3-(trifluoromethyl)phenyl)thiourea
CAS Number:
207919-03-7
Molecular Formula:
C8H6ClF3N2S
Molecular Weight:
254.6598
MDL Number:
MFCD00041182
SMILES:
NC(=S)Nc1ccc(c(c1)C(F)(F)F)Cl
Properties
Properties
 
Form:
Solid  
MP:
142-144℃  

Computed Properties
 
Complexity:
247  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
3.4  

Downstream Synthesis Route

[1]CurrentPatentAssignee:DRREDDY'SLABORATORIESLIMITED-WO2007/2461,2007,A1Locationinpatent:Page/Pagecolumn23

[2]Zhu,Junsheng;Han,Le;Diao,Yanyan;Ren,Xiaoli;Xu,Minghao;Xu,Liuxin;Li,Shiliang;Li,Qiang;Dong,Dong;Huang,Jin;Liu,Xiaofeng;Zhao,Zhenjiang;Wang,Rui;Zhu,Lili;Xu,Yufang;Qian,Xuhong;Li,Honglin[JournalofMedicinalChemistry,2015,vol.58,#3,p.1123-1139]

[1]CurrentPatentAssignee:DRREDDY'SLABORATORIESLIMITED-WO2007/2461,2007,A1Locationinpatent:Page/Pagecolumn23

207919-03-7    70-23-5   
C13H10ClF3N2O2S 

[1]CurrentPatentAssignee:DRREDDY'SLABORATORIESLIMITED-WO2007/2461,2007,A1Locationinpatent:Page/Pagecolumn25-26

[1]CurrentPatentAssignee:SANOFI-WO2006/24034,2006,A1Locationinpatent:Page/Pagecolumn81

[2]CurrentPatentAssignee:SANOFI-WO2006/24034,2006,A1Locationinpatent:Page/Pagecolumn125

207919-03-7    94-02-0   
ethyl2-((4-chloro-3-(trifluoromethyl)phenyl)amino)-4-phenylthiazole-5-carboxylate 

[1]Zhu,Junsheng;Han,Le;Diao,Yanyan;Ren,Xiaoli;Xu,Minghao;Xu,Liuxin;Li,Shiliang;Li,Qiang;Dong,Dong;Huang,Jin;Liu,Xiaofeng;Zhao,Zhenjiang;Wang,Rui;Zhu,Lili;Xu,Yufang;Qian,Xuhong;Li,Honglin[JournalofMedicinalChemistry,2015,vol.58,#3,p.1123-1139]

Literature

Title: Rational design of 5'-thiourea-substituted alpha-thymidine analogues as thymidine monophosphate kinase inhibitors capable of inhibiting mycobacterial growth.

Journal: Journal of medicinal chemistry 20071101

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SDS
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Tags:207919-03-7 Molecular Formula|207919-03-7 MDL|207919-03-7 SMILES|207919-03-7 1-(4-Chloro-3-(trifluoromethyl)phenyl)thiourea