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Samelisant

CAT: 0013-GTR19166773-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19166773-01Size:1 mg
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Description
Samelisant (SUVN-G3031) is a potent, selective inverse agonist of the histamine H3 receptor, exhibiting Kis of 8.7 nM (human) and 9.8 nM (rat) . It demonstrates anticataplectic activity in vivo and is a valuable research tool for investigating narcolepsy and related sleep/wake disorders in both in vitro and in vivo experimental models.
CAS Number
1394808-82-2
Product Name Alternative
H3 receptor, Histamine Receptor, HistamineReceptor, SUVN-G 3031, SUVN-G3031, SUVN-G-3031, Samelisant
Field of Research
Immunology & Inflammation, Neuroscience, Pharmacology & Drug Discovery
Purity
99.09% (May vary between batches)
Solubility
DMSO:50 mg/mL (133.87 mM)
Smiles
O (C1CCN (CC1) C2CCC2) C3=CC=C (NC (CN4CCOCC4) =O) C=C3
Molecular Formula
C21H31N3O3
Molecular Weight
373.49
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Samelisant

SUVN-G3031 is under investigation in clinical trial NCT02342041 (A Study to Investigate the Safety, Tolerability and Pharmacokinetics of SUVN-G3031 in Healthy Subjects).

CAS Number1394808-82-2
PubChem CID60151477
IUPAC NameN-[4-(1-cyclobutylpiperidin-4-yl)oxyphenyl]-2-morpholin-4-ylacetamide
Molecular FormulaC21H31N3O3
Molecular Weight373.5
XLogP2.3
Topological Polar Surface Area54
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count27
Formal Charge0
Complexity463
SMILES
C1CC(C1)N2CCC(CC2)OC3=CC=C(C=C3)NC(=O)CN4CCOCC4
InChI
InChI=1S/C21H31N3O3/c25-21(16-23-12-14-26-15-13-23)22-17-4-6-19(7-5-17)27-20-8-10-24(11-9-20)18-2-1-3-18/h4-7,18,20H,1-3,8-16H2,(H,22,25)
InChIKey
LNXDUSQEXVQFGP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Samelisant
CAS: 1394808-82-2
CID: 60151477
Formula: C21H31N3O3
MW: 373.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight373.5
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass373.23654186
Monoisotopic Mass373.23654186
Topological Polar Surface Area54 Ų
Heavy Atom Count27
Formal Charge0
Complexity463
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

Alternative Products

CatalogName
BA5415-5.1Samelisant
HY-122608Samelisant (free base)
T34752-01Samelisant dihydrochloride

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