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Chlorisondamine chloride

CAT: 0931-T68858-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T68858-01Size:25 mg
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CAS Number
69-27-2
Target
Others, AChR
Related Pathways
Neuroscience, Others
Bioactivity
Chlorisondamine chloride is a nicotinic antagonist used primarily as a ganglionic blocker in animal research. It has been used as an antihypertensive agent but has been supplanted by more specific drugs in most clinical applications.
Smiles
[Cl-].[Cl-].C[N+](C)(C)CC[N+]1(C)Cc2c(C1)c(Cl)c(Cl)c(Cl)c2Cl
Molecular Formula
C14H20Cl6N2
Molecular Weight
429.03
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Chlorisondamine Chloride
CAS Number69-27-2
PubChem CID6243
IUPAC Nametrimethyl-[2-(4,5,6,7-tetrachloro-2-methyl-1,3-dihydroisoindol-2-ium-2-yl)ethyl]azanium dichloride
Molecular FormulaC14H20Cl6N2
Molecular Weight429.0
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count22
Formal Charge0
Complexity336
SMILES
C[N+]1(CC2=C(C1)C(=C(C(=C2Cl)Cl)Cl)Cl)CC[N+](C)(C)C.[Cl-].[Cl-]
InChI
InChI=1S/C14H20Cl4N2.2ClH/c1-19(2,3)5-6-20(4)7-9-10(8-20)12(16)14(18)13(17)11(9)15;;/h5-8H2,1-4H3;2*1H/q+2;;/p-2
InChIKey
DXXUGBPKQDTBQW-UHFFFAOYSA-L
Chemical Structure
2D Structure
2D structure of Chlorisondamine Chloride
CAS: 69-27-2
CID: 6243
Formula: C14H20Cl6N2
MW: 429.0
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight429.0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass427.972815
Monoisotopic Mass425.975765
Topological Polar Surface Area0 Ų
Heavy Atom Count22
Formal Charge0
Complexity336
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes