Products for Research Use Only

Metixene

CAT: 0013-GTR19223119-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19223119-02Size:25 mg
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Description
Metixene is a synthetic anticholinergic agent developed for Parkinson's disease therapy. It is utilized in pharmacological research to study muscarinic receptor antagonism, with applications in both in vitro binding assays and in vivo models of movement disorders.
CAS Number
4969-02-2
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
S1C=2C=CC=CC2C (C=3C=CC=CC13) CC4CN (C) CCC4
Molecular Formula
C20H23NS
Molecular Weight
309.47
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Metixene

Metixene is a member of piperidines and a member of thioxanthenes. It has a role as a histamine antagonist, an antiparkinson drug and a muscarinic antagonist.

CAS Number4969-02-2
PubChem CID4167
IUPAC Name1-methyl-3-(9H-thioxanthen-9-ylmethyl)piperidine
Molecular FormulaC20H23NS
Molecular Weight309.5
XLogP4.9
Topological Polar Surface Area28.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count22
Formal Charge0
Complexity349
SMILES
CN1CCCC(C1)CC2C3=CC=CC=C3SC4=CC=CC=C24
InChI
InChI=1S/C20H23NS/c1-21-12-6-7-15(14-21)13-18-16-8-2-4-10-19(16)22-20-11-5-3-9-17(18)20/h2-5,8-11,15,18H,6-7,12-14H2,1H3
InChIKey
MJFJKKXQDNNUJF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Metixene
CAS: 4969-02-2
CID: 4167
Formula: C20H23NS
MW: 309.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight309.5
XLogP34.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass309.15512091
Monoisotopic Mass309.15512091
Topological Polar Surface Area28.5 Ų
Heavy Atom Count22
Formal Charge0
Complexity349
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes