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374067-80-8,MFCD17015090
Catalog No.:AA00C91P

374067-80-8 | 4-((4-Hydroxy-6-oxo-1,6-dihydropyrimidin-2-yl)amino)benzonitrile

This product is typically in stock,please click "Inquire" below or
contact us at [email protected] for pricing and availability information.
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00C91P
Chemical Name:
4-((4-Hydroxy-6-oxo-1,6-dihydropyrimidin-2-yl)amino)benzonitrile
CAS Number:
374067-80-8
Molecular Formula:
C11H8N4O2
Molecular Weight:
228.2068
MDL Number:
MFCD17015090
SMILES:
N#Cc1ccc(cc1)Nc1nc(O)cc(=O)[nH]1
Properties
Properties
 
MP:
187-189°C  
Storage:
2-8℃;  

Computed Properties
 
Complexity:
424  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
0.2  

Downstream Synthesis Route

[1]BioorganicandMedicinalChemistryLetters,2001,vol.11,p.2235-2239

[2]Patent:WO2012/1695,2012,A1

[3]Patent:US2013/96148,2013,A1

[4]Patent:US2015/336900,2015,A1

[1]Patent:WO2012/1695,2012,A1.Locationinpatent:Page/Pagecolumn11

[2]Patent:US2013/96148,2013,A1.Locationinpatent:Paragraph0087

[3]Patent:US2015/336900,2015,A1.Locationinpatent:Paragraph0029;0030

Literature
Quotation Request
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SDS
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Tags:374067-80-8 Molecular Formula|374067-80-8 MDL|374067-80-8 SMILES|374067-80-8 4-((4-Hydroxy-6-oxo-1,6-dihydropyrimidin-2-yl)amino)benzonitrile
Catalog No.: AA00C91P
374067-80-8,MFCD17015090
374067-80-8 | 4-((4-Hydroxy-6-oxo-1,6-dihydropyrimidin-2-yl)amino)benzonitrile
This product is typically in stock,please click "Inquire" below or contact us at [email protected]for pricing and availability information.
Inquire
Technical Information
Catalog Number: AA00C91P
Chemical Name: 4-((4-Hydroxy-6-oxo-1,6-dihydropyrimidin-2-yl)amino)benzonitrile
CAS Number: 374067-80-8
Molecular Formula: C11H8N4O2
Molecular Weight: 228.2068
MDL Number: MFCD17015090
SMILES: N#Cc1ccc(cc1)Nc1nc(O)cc(=O)[nH]1
Properties
MP: 187-189°C  
Storage: 2-8℃;  
Complexity: 424  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 17  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 3  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 0.2  
Downstream Synthesis Route
374067-80-8    269055-15-4 

[1]BioorganicandMedicinalChemistryLetters,2001,vol.11,p.2235-2239

[2]Patent:WO2012/1695,2012,A1

[3]Patent:US2013/96148,2013,A1

[4]Patent:US2015/336900,2015,A1

5637-42-3    105-53-3    374067-80-8 

[1]Patent:WO2012/1695,2012,A1.Locationinpatent:Page/Pagecolumn11

[2]Patent:US2013/96148,2013,A1.Locationinpatent:Paragraph0087

[3]Patent:US2015/336900,2015,A1.Locationinpatent:Paragraph0029;0030

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