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SLF1081851

CAT: 0804-HY-149004-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-149004-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
SLF1081851 is a Spns2 inhibitor, inhibits S1P release (IC50=1.93 μM) . SLF1081851 plays a key role in development and immune system[1][2].
CAS Number
2763730-97-6
UNSPSC
12352005
Target
LPL Receptor
Type
Reference compound
Related Pathways
GPCR/G Protein
Applications
COVID-19-immunoregulation
Field of Research
Inflammation/Immunology
Assay Protocol
https://www.medchemexpress.com/slf1081851.html
Purity
98.02
Solubility
Ethanol : 10 mg/mL (ultrasonic)
Smiles
NCCCC1=NC(C2=CC=C(CCCCCCCCCC)C=C2)=NO1
Molecular Formula
C21H33N3O
Molecular Weight
343.51
References & Citations
[1]Russell Fritzemeier, et al. Discovery of In Vivo Active Sphingosine-1-phosphate Transporter (Spns2) Inhibitors. J Med Chem. 2022 Jun 9;65 (11) :7656-7681
Shipping Conditions
Room Temperature
Storage Conditions
4°C (Powder, protect from light)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Slf1081851
CAS Number2763730-97-6
PubChem CID164517202
IUPAC Name3-[3-(4-decylphenyl)-1,2,4-oxadiazol-5-yl]propan-1-amine
Molecular FormulaC21H33N3O
Molecular Weight343.5
XLogP6.6
Topological Polar Surface Area64.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count13
Heavy Atom Count25
Formal Charge0
Complexity318
SMILES
CCCCCCCCCCC1=CC=C(C=C1)C2=NOC(=N2)CCCN
InChI
InChI=1S/C21H33N3O/c1-2-3-4-5-6-7-8-9-11-18-13-15-19(16-14-18)21-23-20(25-24-21)12-10-17-22/h13-16H,2-12,17,22H2,1H3
InChIKey
VLTITRMWGPJCFJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Slf1081851
CAS: 2763730-97-6
CID: 164517202
Formula: C21H33N3O
MW: 343.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight343.5
XLogP36.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count13
Exact Mass343.262362685
Monoisotopic Mass343.262362685
Topological Polar Surface Area64.9 Ų
Heavy Atom Count25
Formal Charge0
Complexity318
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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T61112-01SLF1081851
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MBS5805529SLF1081851 TFA
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