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1032229-33-6,MFCD10698997
Catalog No.:AA0085UY

1032229-33-6 | A939572

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
98%
in stock  
$15.00   $11.00
- +
2mg
98%
in stock  
$22.00   $15.00
- +
5mg
98%
in stock  
$33.00   $23.00
- +
50mg
98%
in stock  
$125.00   $88.00
- +
  • 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:
AA0085UY
Chemical Name:
A939572
CAS Number:
1032229-33-6
Molecular Formula:
C20H22ClN3O3
Molecular Weight:
387.8600
MDL Number:
MFCD10698997
SMILES:
CNC(=O)c1cccc(c1)NC(=O)N1CCC(CC1)Oc1ccccc1Cl
Properties
Computed Properties
 
Complexity:
511  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
4  
XLogP3:
3.2  

Upstream Synthesis Route

[1]BioorganicandMedicinalChemistryLetters,2008,vol.18,#15,p.4298-4302

Downstream Synthesis Route
4-(2-chloro-phenoxy)-piperidinehydrochloride 
  1009296-67-6    1032229-33-6 

[1]BioorganicandMedicinalChemistryLetters,2008,vol.18,p.4298-4302

Literature

Title: Metabolic changes in skin caused by Scd1 deficiency: a focus on retinol metabolism.

Journal: PloS one 20110101

Title: Discovery of piperidine-aryl urea-based stearoyl-CoA desaturase 1 inhibitors.

Journal: Bioorganic & medicinal chemistry letters 20080801

Title: Xin Z, et al. Discovery of piperidine-aryl urea-based stearoyl-CoA desaturase 1 inhibitors. Bioorg Med Chem Lett. 2008 Aug 1;18(15):4298-302.

Title: von Roemeling CA, et al. Stearoyl-CoA desaturase 1 is a novel molecular therapeutic target for clear cell renal cell carcinoma. Clin Cancer Res. 2013 May 1;19(9):2368-80.

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SDS
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