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72351-59-8,MFCD00126366
Catalog No.:AA005I2G

72351-59-8 | Ethyl 1,4-dibenzylpiperazine-2-carboxylate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$145.00   $102.00
- +
5g
98%
in stock  
$411.00   $288.00
- +
25g
98%
in stock  
$1,208.00   $846.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA005I2G
Chemical Name:
Ethyl 1,4-dibenzylpiperazine-2-carboxylate
CAS Number:
72351-59-8
Molecular Formula:
C21H26N2O2
Molecular Weight:
338.4433
MDL Number:
MFCD00126366
SMILES:
CCOC(=O)C1CN(CCN1Cc1ccccc1)Cc1ccccc1
Properties
Properties
 
BP:
442 °C at 760 mmHg  
Storage:
-20 ℃;  

Computed Properties
 
Complexity:
403  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
7  
Undefined Atom Stereocenter Count:
1  
XLogP3:
3.4  

Downstream Synthesis Route

[1]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-US2004/192729,2004,A1Locationinpatent:Page35

[2]CurrentPatentAssignee:SEAGENINC-WO2008/112900,2008,A1Locationinpatent:Page/Pagecolumn59

[3]CurrentPatentAssignee:CANCERRESEARCHUK;UNIVERSITYOFLONDON;OTSUKAHOLDINGSCOLTD-WO2005/11697,2005,A2Locationinpatent:Page/Pagecolumn52;82

[4]Locationinpatent:experimentalpartNapolitano,Carmela;Borriello,Manuela;Cardullo,Francesca;Donati,Daniele;Paio,Alfredo;Manfredini,Stefano[SyntheticCommunications,2011,vol.41,#14,p.2031-2035]

[5]CurrentPatentAssignee:MERCK&COINC;LIGANDPHARMACEUTICALSINC-WO2004/33440,2004,A1Locationinpatent:Page294

[6]CurrentPatentAssignee:MERCK&COINC-US2004/147559,2004,A1Locationinpatent:Page160;161

[7]CurrentPatentAssignee:MERCK&COINC-US2004/106794,2004,A1Locationinpatent:Page161

[8]CurrentPatentAssignee:MERCK&COINC;LIGANDPHARMACEUTICALSINC-WO2005/68460,2005,A1Locationinpatent:Page/Pagecolumn257

[9]Butts,CraigP.;Jazdzyk,MikaelD.S.[OrganicandBiomolecularChemistry,2005,vol.3,#7,p.1209-1215]

[10]Butts,CraigP.;Jazdzyk,Mikael[ChemicalCommunications,2003,#13,p.1530-1531]

[11]CurrentPatentAssignee:ERASCA,INC-WO2021/127404,2021,A1Locationinpatent:Paragraph0789;0793-0794

[12]Locationinpatent:experimentalpartKracht,Daniel;Saito,Susumu;Wuensch,Bernhard[AustralianJournalofChemistry,2009,vol.62,#12,p.1684-1689]

[13]CurrentPatentAssignee:SUNPHARMACEUTICALINDUSTRIESLIMITED-US2004/266784,2004,A1

[14]CurrentPatentAssignee:SUNPHARMACEUTICALINDUSTRIESLIMITED-US6943168,2005,B2

[15]CurrentPatentAssignee:APTINYXINC.-WO2018/26782,2018,A1Locationinpatent:Page/Pagecolumn35

[16]CurrentPatentAssignee:SHENZHENDONGYANGGUANGINDUSTRIALDEVELOPMENTCOLTD-US2015/152096,2015,A1Locationinpatent:Paragraph1207-1209

[17]CurrentPatentAssignee:GUANGDONGZHONGSHENGPHARMACEUTICALCO.,LTD.-EP3124482,2017,A1Locationinpatent:Paragraph0110;0111

[18]El-wahab,HendA.A.Abd;Accietto,Mauro;Marino,LeonardoB.;McLean,KirstyJ.;Levy,ColinW.;Abdel-Rahman,HamdyM.;El-Gendy,MahmoudA.;Munro,AndrewW.;Aboraia,AhmedS.;Simons,Claire[BioorganicandMedicinalChemistry,2018,vol.26,#1,p.161-176]

[19]Rondu,Frédéric;Bihan,GaelicLe;Wang,Xuan;Lamouri,Aazdine;Touboul,Estera;Dive,Georges;Bellahsene,Tounès;Pfeiffer,Bruno;Renard,Pierre;Guardiola-Lemaitre,Béatrice;Manechez,Dominique;Penicaud,Luc;Ktorza,Alain;Godfroid,Jean-Jacques[JournalofMedicinalChemistry,1997,vol.40,#23,p.3793-3803]

[20]CurrentPatentAssignee:ORGANON&CO;MERCK&COINC-WO2004/832,2003,A1Locationinpatent:Page28

[21]CurrentPatentAssignee:SERVIERMONDE-WO2012/171506,2012,A1Locationinpatent:Page/Pagecolumn111-112

[22]CurrentPatentAssignee:PFIZERINC-US4940710,1990,A

[1]CurrentPatentAssignee:MERCK&COINC;LIGANDPHARMACEUTICALSINC-WO2008/33764,2008,A2Locationinpatent:Page/Pagecolumn53

[1]CurrentPatentAssignee:SUNPHARMACEUTICALINDUSTRIESLIMITED-US2004/44004,2004,A1

[1]Patent:EP3124482,2017,A1

[1]BioorganicandMedicinalChemistry,2018,vol.26,p.161-176

Literature
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SDS
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Tags:72351-59-8 Molecular Formula|72351-59-8 MDL|72351-59-8 SMILES|72351-59-8 Ethyl 1,4-dibenzylpiperazine-2-carboxylate