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Cevimeline hydrochloride

CAT: 1410-M10294-03Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1410-M10294-03Size:10 mg
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Description
A potent M1-selective muscarinic agonist.
CAS Number
107220-28-0
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
235.774
Molecular Formula
C10H18ClNOS
Notes
Research use only, not for human use.
Receptor
MAChR

Chemical Information

(2R,3'R)-2-methyl-1'-azaspiro((1,3)oxathiolane-5,3'-bicyclo(2.2.2)octane) hydrochloride
CAS Number107220-28-0
PubChem CID123603
IUPAC Name(2R,5R)-2-methylspiro[1,3-oxathiolane-5,3'-1-azabicyclo[2.2.2]octane];hydrochloride
Molecular FormulaC10H18ClNOS
Molecular Weight235.77
Topological Polar Surface Area37.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Heavy Atom Count14
Formal Charge0
Complexity215
SMILES
C[C@@H]1O[C@]2(CN3CCC2CC3)CS1.Cl
InChI
InChI=1S/C10H17NOS.ClH/c1-8-12-10(7-13-8)6-11-4-2-9(10)3-5-11;/h8-9H,2-7H2,1H3;1H/t8-,10-;/m1./s1
InChIKey
SURWTGAXEIEOGY-GHXDPTCOSA-N
Chemical Structure
2D Structure
2D structure of (2R,3'R)-2-methyl-1'-azaspiro((1,3)oxathiolane-5,3'-bicyclo(2.2.2)octane) hydrochloride
CAS: 107220-28-0
CID: 123603
Formula: C10H18ClNOS
MW: 235.77
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight235.77
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass235.0797631
Monoisotopic Mass235.0797631
Topological Polar Surface Area37.8 Ų
Heavy Atom Count14
Formal Charge0
Complexity215
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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