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Tiemonium iodide

CAT: 0013-GTR19199563-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19199563-01Size:25 mg
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Description
Tiemonium iodide is an anticholinergic agent that acts as a muscarinic receptor antagonist, blocking parasympathetic nerve activity. It is utilized in research to investigate smooth muscle function and cholinergic signaling in both in vitro and in vivo experimental models.
CAS Number
6252-92-2
Field of Research
Pharmacology & Drug Discovery
Smiles
C (CC[N+]1 (C) CCOCC1) (O) (C2=CC=CS2) C3=CC=CC=C3
Molecular Formula
C18H24NO2S
Molecular Weight
318.46
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Tiemonium

Tiemonium is a quaternary ammonium ion.

CAS Number6252-92-2
PubChem CID5473
IUPAC Name3-(4-methylmorpholin-4-ium-4-yl)-1-phenyl-1-thiophen-2-ylpropan-1-ol
Molecular FormulaC18H24NO2S+
Molecular Weight318.5
XLogP2.3
Topological Polar Surface Area57.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Heavy Atom Count22
Formal Charge1
Complexity353
SMILES
C[N+]1(CCOCC1)CCC(C2=CC=CC=C2)(C3=CC=CS3)O
InChI
InChI=1S/C18H24NO2S/c1-19(11-13-21-14-12-19)10-9-18(20,17-8-5-15-22-17)16-6-3-2-4-7-16/h2-8,15,20H,9-14H2,1H3/q+1
InChIKey
HJDYAOBDPZQHOD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Tiemonium
CAS: 6252-92-2
CID: 5473
Formula: C18H24NO2S+
MW: 318.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight318.5
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count5
Exact Mass318.15277518
Monoisotopic Mass318.15277518
Topological Polar Surface Area57.7 Ų
Heavy Atom Count22
Formal Charge1
Complexity353
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

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