Home Amines 115891-18-4
115891-18-4,MFCD25542417
Catalog No.:AA000GZM

115891-18-4 | 3-Pyridinecarboxylic acid, 2-(phenylamino)-, ethyl ester

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  • Technical Information
  • Properties
  • Downstream Synthesis Route
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Technical Information
Catalog Number:
AA000GZM
Chemical Name:
3-Pyridinecarboxylic acid, 2-(phenylamino)-, ethyl ester
CAS Number:
115891-18-4
Molecular Formula:
C14H14N2O2
Molecular Weight:
242.2732
MDL Number:
MFCD25542417
SMILES:
CCOC(=O)c1cccnc1Nc1ccccc1
Properties
Computed Properties
 
Complexity:
265  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
5  
XLogP3:
3.5  

Downstream Synthesis Route

[1]Locationinpatent:experimentalpartKamal,Ahmed;Srikanth;NaseerAhmedKhan;Ashraf,Md.;KashiReddy;Sultana,Farheen;Kaur,Tandeep;Chashoo,Gousia;Suri,Nitasha;Sehar,Irum;Wani,ZahoorA.;Saxena,Arpita;Sharma,PardumanR.;Bhushan,Shashi;Mondhe,DilipM.;Saxena,AjitK.[BioorganicandMedicinalChemistry,2011,vol.19,#23,p.7136-7150]

[2]CurrentPatentAssignee:COUNCILOFSCIENTIFICANDINDUSTRIALRESEARCH(IN)-WO2012/111016,2012,A1Locationinpatent:Page/Pagecolumn16-17

[3]CurrentPatentAssignee:COUNCILOFSCIENTIFICANDINDUSTRIALRESEARCH(IN)-US2013/324734,2013,A1Locationinpatent:Paragraph0095

[4]Kamal,Ähmed;Ashraf,Md.;VishnuVardhan;Faazil,Shaikh;Nayak,V.Lakshma[BioorganicandMedicinalChemistryLetters,2014,vol.24,#1,p.147-151]

[1]ChemicalCommunications,2013,vol.49,p.7352-7354

Literature
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SDS
Tags:115891-18-4 Molecular Formula|115891-18-4 MDL|115891-18-4 SMILES|115891-18-4 3-Pyridinecarboxylic acid, 2-(phenylamino)-, ethyl ester