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664993-53-7,MFCD03863265
Catalog No.:AA00FBXB

664993-53-7 | N-[4-({[4-(4-Methoxyphenyl)oxan-4-yl]methyl}carbamoyl)phenyl]furan-2-carboxamide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
98%
in stock  
$14.00   $10.00
- +
10mg
98%
in stock  
$51.00   $36.00
- +
50mg
98%
in stock  
$129.00   $91.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00FBXB
Chemical Name:
N-[4-({[4-(4-Methoxyphenyl)oxan-4-yl]methyl}carbamoyl)phenyl]furan-2-carboxamide
CAS Number:
664993-53-7
Molecular Formula:
C25H26N2O5
Molecular Weight:
434.4843
MDL Number:
MFCD03863265
SMILES:
COc1ccc(cc1)C1(CCOCC1)CNC(=O)c1ccc(cc1)NC(=O)c1ccco1
Properties
Computed Properties
 
Complexity:
620  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
7  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.5  

Upstream Synthesis Route

[1]RussianJournalofGeneralChemistry,2015,vol.85,#5,p.1057-1062

[2]Zh.Obshch.Khim.,2015,vol.85,#5,p.760-764,5

[1]Patent:WO2013/93508,2013,A2,

[1]Patent:WO2013/93508,2013,A2,

[1]RussianJournalofGeneralChemistry,2015,vol.85,#5,p.1057-1062

[2]Zh.Obshch.Khim.,2015,vol.85,#5,p.760-764,5

[1]RussianJournalofGeneralChemistry,2015,vol.85,#5,p.1057-1062

[2]Zh.Obshch.Khim.,2015,vol.85,#5,p.760-764,5

Downstream Synthesis Route

[1]CurrentPatentAssignee:GOLDINGLOUISE;OSLOUNIVERSITYHOSPITALHF-WO2013/93508,2013,A2Locationinpatent:Page/Pagecolumn45

[1]RussianJournalofGeneralChemistry,2015,vol.85,p.1057-1062    Zh.Obshch.Khim.,2015,vol.85,p.760-764,5

440087-51-4   
C12H8ClNO3 
  664993-53-7 

[1]Agekyan;Mkryan[RussianJournalofGeneralChemistry,2015,vol.85,#5,p.1057-1062][Zh.Obshch.Khim.,2015,vol.85,#5,p.760-764,5]

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Waaler J, et al. A novel tankyrase inhibitor decreases canonical Wnt signaling in colon carcinoma cells and reduces tumor growth in conditional APC mutant mice. Cancer Res. 2012 Jun 1;72(11):2822-32.

Quotation Request
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SDS
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Tags:664993-53-7 Molecular Formula|664993-53-7 MDL|664993-53-7 SMILES|664993-53-7 N-[4-({[4-(4-Methoxyphenyl)oxan-4-yl]methyl}carbamoyl)phenyl]furan-2-carboxamide
Catalog No.: AA00FBXB
664993-53-7,MFCD03863265
664993-53-7 | N-[4-({[4-(4-Methoxyphenyl)oxan-4-yl]methyl}carbamoyl)phenyl]furan-2-carboxamide
Pack Size： 1mg
Purity： 98%
in stock
$14.00 $10.00
Pack Size： 10mg
Purity： 98%
in stock
$51.00 $36.00
Pack Size： 50mg
Purity： 98%
in stock
$129.00 $91.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00FBXB
Chemical Name: N-[4-({[4-(4-Methoxyphenyl)oxan-4-yl]methyl}carbamoyl)phenyl]furan-2-carboxamide
CAS Number: 664993-53-7
Molecular Formula: C25H26N2O5
Molecular Weight: 434.4843
MDL Number: MFCD03863265
SMILES: COc1ccc(cc1)C1(CCOCC1)CNC(=O)c1ccc(cc1)NC(=O)c1ccco1
Properties
Complexity: 620  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 32  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 7  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.5  
Upstream Synthesis Route
440087-51-4    664993-53-7 

[1]RussianJournalofGeneralChemistry,2015,vol.85,#5,p.1057-1062

[2]Zh.Obshch.Khim.,2015,vol.85,#5,p.760-764,5

619-45-4    664993-53-7 

[1]Patent:WO2013/93508,2013,A2,

527-69-5    664993-53-7 

[1]Patent:WO2013/93508,2013,A2,

3648-78-0    664993-53-7 

[1]RussianJournalofGeneralChemistry,2015,vol.85,#5,p.1057-1062

[2]Zh.Obshch.Khim.,2015,vol.85,#5,p.760-764,5

104-47-2    664993-53-7 

[1]RussianJournalofGeneralChemistry,2015,vol.85,#5,p.1057-1062

[2]Zh.Obshch.Khim.,2015,vol.85,#5,p.760-764,5

Downstream Synthesis Route
440087-51-4    313375-40-5    664993-53-7 

[1]CurrentPatentAssignee:GOLDINGLOUISE;OSLOUNIVERSITYHOSPITALHF-WO2013/93508,2013,A2Locationinpatent:Page/Pagecolumn45

3648-78-0    664993-53-7 

[1]RussianJournalofGeneralChemistry,2015,vol.85,p.1057-1062    Zh.Obshch.Khim.,2015,vol.85,p.760-764,5

440087-51-4   
C12H8ClNO3 
  664993-53-7 

[1]Agekyan;Mkryan[RussianJournalofGeneralChemistry,2015,vol.85,#5,p.1057-1062][Zh.Obshch.Khim.,2015,vol.85,#5,p.760-764,5]

Literature fold

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters20101101

Title: Waaler J, et al. A novel tankyrase inhibitor decreases canonical Wnt signaling in colon carcinoma cells and reduces tumor growth in conditional APC mutant mice. Cancer Res. 2012 Jun 1;72(11):2822-32.

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