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1234627-85-0

1234627-85-0 structure
1234627-85-0 structure
  • Name: BAF-312 fumarate
  • Chemical Name: Siponimod
  • CAS Number: 1234627-85-0
  • Molecular Formula: C62H74F6N4O10
  • Molecular Weight: 1149.262
  • Catalog: Signaling Pathways GPCR/G Protein LPL Receptor
  • Create Date: 2018-06-19 05:15:55
  • Modify Date: 2024-01-09 17:49:49
  • Siponimod (BAF-312) hemifumarate is a potent and selective sphingosine-1-phosphate (S1P) receptor modulator. Siponimod hemifumarate is selective for S1P1 and S1P5 receptors over S1P2, S1P3, and S1P4 (EC50s of 0.39, 0.98, >10000, >1000, and 750 nM, respectively). Siponimod hemifumarate can be used for multiple sclerosis (MS) research[1][2].

Name Siponimod
Synonyms 3-Azetidinecarboxylic acid, 1-[[4-[(1E)-1-[[[4-cyclohexyl-3-(trifluoromethyl)phenyl]methoxy]imino]ethyl]-2-ethylphenyl]methyl]-, (2E)-2-butenedioate (2:1)
1-{4-[(1E)-N-{[4-Cyclohexyl-3-(trifluoromethyl)benzyl]oxy}ethanimidoyl]-2-ethylbenzyl}-3-azetidinecarboxylic acid (2E)-2-butenedioate (2:1)
MFCD31536984
Siponimod Fumarate
Description Siponimod (BAF-312) hemifumarate is a potent and selective sphingosine-1-phosphate (S1P) receptor modulator. Siponimod hemifumarate is selective for S1P1 and S1P5 receptors over S1P2, S1P3, and S1P4 (EC50s of 0.39, 0.98, >10000, >1000, and 750 nM, respectively). Siponimod hemifumarate can be used for multiple sclerosis (MS) research[1][2].
Related Catalog
Target

S1PR1:0.39 nM (EC50)

S1PR5:0.98 nM (EC50)

S1PR4:750 nM (EC50)

S1PR3:>1000 nM (EC50)

S1PR2:>10000 nM (EC50)

References

[1]. Pan S, et al. Discovery of BAF312 (Siponimod), a Potent and Selective S1P Receptor Modulator. ACS Med Chem Lett. 2013 Jan 4;4(3):333-7.

[2]. McGinley M, et al. Prospects of siponimod in secondary progressive multiple sclerosis. Ther Adv Neurol Disord. 2018 Jul 17;11:1756286418788013.

[3]. Behrangi N, et al. Mechanism of Siponimod: Anti-Inflammatory and Neuroprotective Mode of Action. Cells. 2019 Jan 7;8(1):24.

Molecular Formula C62H74F6N4O10
Molecular Weight 1149.262
Exact Mass 1148.530884