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Trimetaphan camsilate

CAT: 0931-T68811-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T68811-01Size:25 mg
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CAS Number
7187-66-8
Target
Others
Related Pathways
Others
Bioactivity
Trimetaphan camsilate is a drug that counteracts cholinergic transmission at the ganglion type of nicotinic receptors of the autonomic ganglia and therefore blocks both the sympathetic nervous system and the parasympathetic nervous system. It acts as a non-depolarizing competitive antagonist at the nicotinic acetylcholine receptor, is short-acting, and is given intravenously.
Smiles
C(N1C2C(N(CC3=CC=CC=C3)C1=O)C[S+]4C2CCC4)C5=CC=CC=C5
Molecular Formula
C22H25N2OS
Molecular Weight
365.51
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Trimethaphan

Trimethaphan is a complex heterocyclic sulfonium compound with an imidazolium core, used to treat hypertension. It has a role as a vasodilator agent, an antihypertensive agent, a nicotinic antagonist and an anaesthesia adjuvant.

CAS Number7187-66-8
PubChem CID23576
IUPAC Name3,5-dibenzyl-8-thionia-3,5-diazatricyclo[6.3.0.02,6]undecan-4-one
Molecular FormulaC22H25N2OS+
Molecular Weight365.5
XLogP3.6
Topological Polar Surface Area24.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Heavy Atom Count26
Formal Charge1
Complexity514
SMILES
C1CC2C3C(C[S+]2C1)N(C(=O)N3CC4=CC=CC=C4)CC5=CC=CC=C5
InChI
InChI=1S/C22H25N2OS/c25-22-23(14-17-8-3-1-4-9-17)19-16-26-13-7-12-20(26)21(19)24(22)15-18-10-5-2-6-11-18/h1-6,8-11,19-21H,7,12-16H2/q+1
InChIKey
CHQOEHPMXSHGCL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Trimethaphan
CAS: 7187-66-8
CID: 23576
Formula: C22H25N2OS+
MW: 365.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight365.5
XLogP33.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count4
Exact Mass365.16875960
Monoisotopic Mass365.16875960
Topological Polar Surface Area24.6 Ų
Heavy Atom Count26
Formal Charge1
Complexity514
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count3
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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