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VSN-16

CAT: 0013-GTR19196187-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19196187-01Size:25 mg
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Description
VSN-16 is a synthetic cannabinoid receptor agonist investigated for its therapeutic potential in multiple sclerosis-related spasticity. Research applications include in vitro receptor binding assays and in vivo models of neuroinflammation and muscle tone regulation.
CAS Number
863713-78-4
Field of Research
Pharmacology & Drug Discovery
Smiles
C (NC (CO) C) (=O) C1=CC (/C=C\CCCC (N (C) C) =O) =CC=C1
Molecular Formula
C18H26N2O3
Molecular Weight
318.41
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(Z)-3-(6-(dimethylamino)-6-oxohex-1-en-1-yl)-N-(1-hydroxypropan-2-yl)benzamide
CAS Number863713-78-4
PubChem CID11336127
IUPAC Name3-[(Z)-6-(dimethylamino)-6-oxohex-1-enyl]-N-(1-hydroxypropan-2-yl)benzamide
Molecular FormulaC18H26N2O3
Molecular Weight318.4
XLogP1.6
Topological Polar Surface Area69.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count8
Heavy Atom Count23
Formal Charge0
Complexity407
SMILES
CC(CO)NC(=O)C1=CC=CC(=C1)/C=C\CCCC(=O)N(C)C
InChI
InChI=1S/C18H26N2O3/c1-14(13-21)19-18(23)16-10-7-9-15(12-16)8-5-4-6-11-17(22)20(2)3/h5,7-10,12,14,21H,4,6,11,13H2,1-3H3,(H,19,23)/b8-5-
InChIKey
SVYRYFAUQHVGAI-YVMONPNESA-N
Chemical Structure
2D Structure
2D structure of (Z)-3-(6-(dimethylamino)-6-oxohex-1-en-1-yl)-N-(1-hydroxypropan-2-yl)benzamide
CAS: 863713-78-4
CID: 11336127
Formula: C18H26N2O3
MW: 318.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight318.4
XLogP31.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count8
Exact Mass318.19434270
Monoisotopic Mass318.19434270
Topological Polar Surface Area69.6 Ų
Heavy Atom Count23
Formal Charge0
Complexity407
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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HY-122153-01VSN-16
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