CAS: 1230487-00-9 - Siponimod

Formula: C₂₉H₃₅F₃N₂O₃

InChI: InChI=1S/C29H35F3N2O3/c1-3-21-14-23(10-11-24(21)15-34-16-25(17-34)28(35)36)19(2)33-37-18-20-9-12-26(22-7-5-4-6-8-22)27(13-20)29(30,31)32/h9-14,22,25H,3-8,15-18H2,1-2H3,(H,35,36)/b33-19+

InChI key: InChIKey=KIHYPELVXPAIDH-HNSNBQBZSA-N

SMILES: O=C(O)C1CN(CC2=CC=C(C=C2CC)C(=NOCC3=CC=C(C(=C3)C(F)(F)F)C4CCCCC4)C)C1

Synonyms:

• 3-Azetidinecarboxylic acid, 1-[[4-[(1E)-1-[[[4-cyclohexyl-3-(trifluoromethyl)phenyl]methoxy]imino]ethyl]-2-ethylphenyl]methyl]-
• 1-[[4-[(1E)-1-[[[4-Cyclohexyl-3-(trifluoromethyl)phenyl]methoxy]imino]ethyl]-2-ethylphenyl]methyl]-3-azetidinecarboxylic acid
• BAF 312
• Siponimod
• 1-(4-[1-[(E)-4-Cyclohexyl-3-trifluoromethyl-benzyloxyimino]-ethyl]-2-ethyl-benzyl)-azetidine-3-carboxylic acid

BAF-312(SiponiMod)

CAS: 1230487-00-9

• Formula: C₂₉H₃₅F₃N₂O₃
• Purity: 98%
• Color and Shape: Solid
• Molecular weight: 516.5950

Siponimod Trifluoroacetate

CAS: 1230487-00-9

• Formula: C₂₉H₃₅F₃N₂O₃·C₂HF₃O₂
• Molecular weight: 516.61 114.02

Siponimod-d5

CAS: 1230487-00-9

• Formula: C₂₉H₃₀D₅F₃N₂O₃
• Molecular weight: 521.64

Siponimod

CAS: 1230487-00-9

Siponimod (BAF312) modulates S1P1/S1P5 with EC50s of 0.39/0.98 nM; >1000x selectivity over S1P2-4.

• Formula: C₂₉H₃₅F₃N₂O₃
• Purity: 97.08% - 99.29%
• Color and Shape: Solid
• Molecular weight: 516.59

Siponimod

CAS: 1230487-00-9

Applications Siponimod is a functional sphingosine -1 phosphate (SIP) antagonist used in the treatment of …

• Formula: C₂₉H₃₅F₃N₂O₃
• Color and Shape: Light Yellow
• Molecular weight: 516.6

Siponimod

CAS: 1230487-00-9

Sphingosine-1-phosphate receptor modulator

• Formula: C₂₉H₃₅F₃N₂O₃
• Purity: Min. 95%
• Color and Shape: Powder
• Molecular weight: 516.6 g/mol

Siponimod-D11

CAS: 1230487-00-9

• Formula: C₂₉D₁₁H₂₄F₃N₂O₃
• Color and Shape: Neat
• Molecular weight: 527.663

Siponimod N-Oxide

CAS: 1230487-00-9

• Formula: C₂₉H₃₅F₃N₂O₄
• Color and Shape: Neat
• Molecular weight: 532.6