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Home Pyridines 1262414-04-9
1262414-04-9,MFCD30530772
Catalog No.:AA000SC4

1262414-04-9 | 1,2-Propanediol, 3-[4-[5-(2-cyclopentyl-6-methoxy-4-pyridinyl)-1,2,4-oxadiazol-3-yl]-2-ethyl-6-methylphenoxy]-, (2S)-

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5mg
≥95%
in stock  
$103.00   $72.00
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10mg
≥95%
in stock  
$193.00   $135.00
- +
25mg
98%
in stock  
$315.00   $220.00
- +
100mg
95%
in stock  
$1,016.00   $711.00
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1g
98%
in stock  
$3,918.00   $2,743.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000SC4
Chemical Name:
1,2-Propanediol, 3-[4-[5-(2-cyclopentyl-6-methoxy-4-pyridinyl)-1,2,4-oxadiazol-3-yl]-2-ethyl-6-methylphenoxy]-, (2S)-
CAS Number:
1262414-04-9
Molecular Formula:
C25H31N3O5
Molecular Weight:
453.5307
MDL Number:
MFCD30530772
SMILES:
OC[C@@H](COc1c(C)cc(cc1CC)c1noc(n1)c1cc(OC)nc(c1)C1CCCC1)O
Properties
Computed Properties
 
Complexity:
592  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
33  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
9  
XLogP3:
4.2  

Downstream Synthesis Route

[1]OrganicProcessResearchandDevelopment,2016,vol.20,p.1637-1646

[2]OrganicProcessResearchandDevelopment,2016,vol.20,p.1637-1646

[3]OrganicProcessResearchandDevelopment,2016,vol.20,p.1637-1646

42521-09-5    1262414-04-9   
C24H29N3O5 

[1]OrganicProcessResearchandDevelopment,2016,vol.20,p.1637-1646

[1]OrganicProcessResearchandDevelopment,2016,vol.20,p.1637-1646

[2]OrganicProcessResearchandDevelopment,2016,vol.20,p.1637-1646

[3]OrganicProcessResearchandDevelopment,2016,vol.20,p.1637-1646

15855-06-8    1262414-04-9   
C24H29N3O5 

[1]OrganicProcessResearchandDevelopment,2016,vol.20,p.1637-1646

[1]OrganicProcessResearchandDevelopment,2016,vol.20,p.1637-1646

Literature

Title: Cenerimod, a novel selective S1P(1) receptor modulator with unique signaling properties.

Journal: Pharmacology research & perspectives 20171201

Title: Microbial spoilage of fresh refrigerated beef liver.

Journal: The Journal of applied bacteriology 19751201

Title: Piali L, et, al. Cenerimod, a novel selective S1P 1 receptor modulator with unique signaling properties. Pharmacol Res Perspect. 2017 Dec;5(6):e00370.

Title: Kano M, et, al. Attenuation of murine sclerodermatous models by the selective S1P 1 receptor modulator cenerimod. Sci Rep. 2019 Jan 24;9(1):658.

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SDS
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Tags:1262414-04-9 Molecular Formula|1262414-04-9 MDL|1262414-04-9 SMILES|1262414-04-9 1,2-Propanediol, 3-[4-[5-(2-cyclopentyl-6-methoxy-4-pyridinyl)-1,2,4-oxadiazol-3-yl]-2-ethyl-6-methylphenoxy]-, (2S)-