N,N-Dicyclohexyl-5-cyclopropyl-3-isoxazolecarboxamide

ChemicalBook > CAS DataBase List > N,N-Dicyclohexyl-5-cyclopropyl-3-isoxazolecarboxamide

N,N-Dicyclohexyl-5-cyclopropyl-3-isoxazolecarboxamide

Product Name: N,N-Dicyclohexyl-5-cyclopropyl-3-isoxazolecarboxamide
CAS No.: 945128-26-7
Chemical Name: N,N-Dicyclohexyl-5-cyclopropyl-3-isoxazolecarboxamide
Synonyms: ML249;CYM5541;CYM-5541;CID-17253208;CYM 5541(ML-249);CYM-5541;CYM 5541;ML-249;ML 249;ML249;N,N-Dicyclohexyl-5-cyclopropyl-3-isoxazolecarboxamide;N,N-Dicyclohexyl-5-cyclopropylisoxazole-3-carboxamide;3-Isoxazolecarboxamide, N,N-dicyclohexyl-5-cyclopropyl-;N,N-dicyclohexyl-5-cyclopropyl-1,2-oxazole-3-carboxamide
CBNumber: CB72750683
Molecular Formula: C19H28N2O2
Formula Weight: 316.44
MOL File: 945128-26-7.mol

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N,N-Dicyclohexyl-5-cyclopropyl-3-isoxazolecarboxamide Property

Boiling point:: 503.1±38.0 °C(Predicted)
Density: 1.14±0.1 g/cm3(Predicted)
storage temp.: 2-8°C
solubility: DMSO: soluble5mg/mL, clear (warmed)
form: powder
pka: -2.57±0.20(Predicted)
color: white to beige
Stability:: Stable for 1 year from date of purchase as supplied. Solutions in DMSO or ethanol may be stored at -20° for up to 1 month.

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Safety

Hazard Codes: Xn
Risk Statements: 22
WGK Germany: 3

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Hazard and Precautionary Statements (GHS)

Symbol(GHS)

Signal word

Warning

Hazard statements

H302Harmful if swallowed

Precautionary statements

P280Wear protective gloves/protective clothing/eye protection/face protection.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

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N-Bromosuccinimide Price

Sigma-Aldrich

Product number: SML0680
Product name: CYM-5541
Purity: ≥98% (HPLC)
Packaging: 5mg
Price: $123
Updated: 2024/03/01

Sigma-Aldrich

Product number: SML0680
Product name: CYM-5541
Purity: ≥98% (HPLC)
Packaging: 25mg
Price: $154.4
Updated: 2024/03/01

Cayman Chemical

Product number: 15190
Product name: CYM 5541
Purity: ≥98%
Packaging: 5mg
Price: $62
Updated: 2024/03/01

Cayman Chemical

Product number: 15190
Product name: CYM 5541
Purity: ≥98%
Packaging: 10mg
Price: $115
Updated: 2024/03/01

Cayman Chemical

Product number: 15190
Product name: CYM 5541
Purity: ≥98%
Packaging: 25mg
Price: $211
Updated: 2024/03/01

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N,N-Dicyclohexyl-5-cyclopropyl-3-isoxazolecarboxamide Chemical Properties,Usage,Production

Description

The sphingosine 1-phosphate (S1P) receptor S1P₃ has roles in vasodilation, epithelial barrier function, cardioprotection, fibrosis, immunity, and inflammation. CYM 5541 is a selective, allosteric agonist of S1P₃ (EC₅₀ = 72-132 nM). It less effectively activates S1P₁ (EC₅₀ = 28-38 μM) and is ineffective at S1P₂, S1P₄, and S1P₅ as well as a panel of other receptors, ion channels and transporters.

Uses

CYM 5541, is a selective allosteric agonist of SAR and S1P3 receptors.

Biochem/physiol Actions

CYM-5541 is an allosteric agonist selective for the Sphingosine 1-phosphate (S1P) S1P3 receptor subtype. CYM-5541 occupies a different chemical space in the ligand binding pocket of S1P3 than S1P does, a lower hydrophobic region around transmembrane helix TM6. CYM-5541 shows great selectivity and stability with an EC50 of between 72 and 132 nM compared to S1P1 EC50 > 10 μM, S1P2 EC50 > 50 μM, S1P4 EC50 > 50 μM, and S1P5 EC50 > 25 μM and no significant activities for a panel of 55 GPCRs, ion channels, and transporters.

storage

Store at +4°C

References

1) Guerrero?et al.?(2011),?Probe Development Efforts for an Allosteric Agonist of Sphingosine 1-phosphate Receptor 3 (S1P3); Probe Reports from the NIH Molecular Libraries Program 2) Jo?et al.?(2012),?Novel Selective Allosteric and Bitopic Ligands for the S1P3 Receptor; ACS Chem. Biol.?7?1975

N,N-Dicyclohexyl-5-cyclopropyl-3-isoxazolecarboxamide Preparation Products And Raw materials

Raw materials

Preparation Products

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