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Home Fluorides 820240-77-5
820240-77-5
Catalog No.:AA01EPQM

820240-77-5 | N-[[2-[2-(trifluoromethyl)[1,1'-biphenyl]-4-yl]benzo[b]thien-5-yl]methyl]-β-alanine

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Purity
Availability
Price(USD)
Quantity
  
1mg
≥98%
in stock  
$173.00   $121.00
- +
5mg
≥98%
in stock  
$529.00   $370.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA01EPQM
Chemical Name:
N-[[2-[2-(trifluoromethyl)[1,1'-biphenyl]-4-yl]benzo[b]thien-5-yl]methyl]-β-alanine
CAS Number:
820240-77-5
Molecular Formula:
C25H20F3NO2S
Molecular Weight:
455.4920
SMILES:
OC(=O)CCNCc1ccc2c(c1)cc(s2)c1ccc(c(c1)C(F)(F)F)c1ccccc1
Properties
Computed Properties
 
Complexity:
625  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
7  
XLogP3:
3.7  

Literature

Title: The dual S1PR1/S1PR5 drug BAF312 (Siponimod) attenuates demyelination in organotypic slice cultures.

Journal: Journal of neuroinflammation 20160101

Title: A sphingosine-1-phosphate receptor 1-directed agonist reduces central nervous system inflammation in a plasmacytoid dendritic cell-dependent manner.

Journal: Journal of immunology (Baltimore, Md. : 1950) 20121001

Title: Sphingosine-1-phosphate-induced airway hyper-reactivity in rodents is mediated by the sphingosine-1-phosphate type 3 receptor.

Journal: The Journal of pharmacology and experimental therapeutics 20120801

Title: Modulation of chemokines and allergic airway inflammation by selective local sphingosine-1-phosphate receptor 1 agonism in lungs.

Journal: Molecular pharmacology 20110101

Title: Prolonged exposure to sphingosine 1-phosphate receptor-1 agonists exacerbates vascular leak, fibrosis, and mortality after lung injury.

Journal: American journal of respiratory cell and molecular biology 20101201

Title: Treatment with a sphingosine analog does not alter the outcome of a persistent virus infection.

Journal: Virology 20100220

Title: AUY954, a selective S1P(1) modulator, prevents experimental autoimmune neuritis.

Journal: Journal of neuroimmunology 20091130

Title: Activation of the lung S1P(1) receptor reduces allergen-induced plasma leakage in mice.

Journal: British journal of pharmacology 20091101

Title: Endogenous EPCR/aPC-PAR1 signaling prevents inflammation-induced vascular leakage and lethality.

Journal: Blood 20090319

Title: beta-Arrestin recruitment assay for the identification of agonists of the sphingosine 1-phosphate receptor EDG1.

Journal: Journal of biomolecular screening 20081201

Title: Phosphorylated FTY720 promotes astrocyte migration through sphingosine-1-phosphate receptors.

Journal: Journal of neurochemistry 20070801

Title: Synthesis and biological evaluation of gamma-aminophosphonates as potent, subtype-selective sphingosine 1-phosphate receptor agonists and antagonists.

Journal: Bioorganic & medicinal chemistry 20070115

Title: A monoselective sphingosine-1-phosphate receptor-1 agonist prevents allograft rejection in a stringent rat heart transplantation model.

Journal: Chemistry & biology 20061101

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Tags:820240-77-5 Molecular Formula|820240-77-5 MDL|820240-77-5 SMILES|820240-77-5 N-[[2-[2-(trifluoromethyl)[1,1'-biphenyl]-4-yl]benzo[b]thien-5-yl]methyl]-β-alanine