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285983-48-4,MFCD09752957
Catalog No.:AA002VQJ

285983-48-4 | 3-[3-tert-butyl-1-(4-methylphenyl)-1H-pyrazol-5-yl]-1-{4-[2-(morpholin-4-yl)ethoxy]naphthalen-1-yl}urea

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1mg
99%
in stock  
$12.00   $8.00
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2mg
99%
in stock  
$17.00   $12.00
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5mg
99%
in stock  
$27.00   $19.00
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10mg
99%
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$39.00   $28.00
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50mg
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$110.00   $77.00
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100mg
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$145.00   $102.00
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250mg
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$211.00   $148.00
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1g
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$510.00   $357.00
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5g
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in stock  
$2,007.00   $1,405.00
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  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002VQJ
Chemical Name:
3-[3-tert-butyl-1-(4-methylphenyl)-1H-pyrazol-5-yl]-1-{4-[2-(morpholin-4-yl)ethoxy]naphthalen-1-yl}urea
CAS Number:
285983-48-4
Molecular Formula:
C31H37N5O3
Molecular Weight:
527.6572
MDL Number:
MFCD09752957
SMILES:
O=C(Nc1cc(nn1c1ccc(cc1)C)C(C)(C)C)Nc1ccc(c2c1cccc2)OCCN1CCOCC1
Properties
Computed Properties
 
Complexity:
777  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
39  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
8  
XLogP3:
5.7  

Upstream Synthesis Route

[1]Patent:US2012/184735,2012,A1,.Locationinpatent:Page/Pagecolumn37

[1]Patent:US2002/123631,2002,A1,

[1]Patent:US2003/232865,2003,A1,.Locationinpatent:Page34-35

[1]Patent:US2004/33222,2004,A1,

[1]TetrahedronLetters,2010,vol.51,#34,p.4547-4551

Downstream Synthesis Route

[1]Regan,John;Moss,Neil;Pargellis,Chris;Pav,Sue;Proto,Alfred;Swinamer,Alan;Tong,Liang;Torcellini,Carol;Breitfelder,Steffen;Cirillo,Pier;Gilmore,Thomas;Graham,AnneG.;Hickey,Eugene;Klaus,Bernhard;Madwed,Jeffrey;Moriak,Monica[JournalofMedicinalChemistry,2002,vol.45,#14,p.2994-3008]

[1]Latli,Bachir[Journaloflabelledcompoundsandradiopharmaceuticals,2004,vol.47,#12,p.847-856]

[1]Regan,John;Moss,Neil;Pargellis,Chris;Pav,Sue;Proto,Alfred;Swinamer,Alan;Tong,Liang;Torcellini,Carol;Breitfelder,Steffen;Cirillo,Pier;Gilmore,Thomas;Graham,AnneG.;Hickey,Eugene;Klaus,Bernhard;Madwed,Jeffrey;Moriak,Monica[JournalofMedicinalChemistry,2002,vol.45,#14,p.2994-3008]

[2]CurrentPatentAssignee:TORAYINDUSTRIESINC-US2012/184735,2012,A1

[1]Regan,John;Moss,Neil;Pargellis,Chris;Pav,Sue;Proto,Alfred;Swinamer,Alan;Tong,Liang;Torcellini,Carol;Breitfelder,Steffen;Cirillo,Pier;Gilmore,Thomas;Graham,AnneG.;Hickey,Eugene;Klaus,Bernhard;Madwed,Jeffrey;Moriak,Monica[JournalofMedicinalChemistry,2002,vol.45,#14,p.2994-3008]

[1]Regan,John;Moss,Neil;Pargellis,Chris;Pav,Sue;Proto,Alfred;Swinamer,Alan;Tong,Liang;Torcellini,Carol;Breitfelder,Steffen;Cirillo,Pier;Gilmore,Thomas;Graham,AnneG.;Hickey,Eugene;Klaus,Bernhard;Madwed,Jeffrey;Moriak,Monica[JournalofMedicinalChemistry,2002,vol.45,#14,p.2994-3008]

[2]CurrentPatentAssignee:TORAYINDUSTRIESINC-US2012/184735,2012,A1

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Tags:285983-48-4 Molecular Formula|285983-48-4 MDL|285983-48-4 SMILES|285983-48-4 3-[3-tert-butyl-1-(4-methylphenyl)-1H-pyrazol-5-yl]-1-{4-[2-(morpholin-4-yl)ethoxy]naphthalen-1-yl}urea