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Paroxetine Mesylate

CAT: 0607-C8698-50Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0607-C8698-50Size:50 mg
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Description
Selective 5 - hydroxytryptamine reuptake inhibitor (SSRI)
CAS Number
217797-14-3
Product Name Alternative
(3S,4R) -3- ((benzo[d][1,3]dioxol-5-yloxy) methyl) -4- (4-fluorophenyl) piperidine methanesulfonate
Synonyms
BRL29060 mesylate
Smiles
CS (O) (=O) =O.FC1=CC=C (C=C1) [C@@H]1CCNC[C@H]1COC1=CC2=C (OCO2) C=C1
Molecular Formula
C20H24FNO6S
Molecular Weight
425.47
Storage Conditions
Store at -20°C

Chemical Information

Paroxetine Mesylate

Paroxetine Mesylate is the mesylate salt form of paroxetine, a phenylpiperidine derivative and a selective serotonin reuptake inhibitor (SSRI) with antidepressant and anxiolytic properties. Paroxetine binds to the pre-synaptic serotonin transporter complex resulting in negative allosteric modulation of the complex, thereby blocking reuptake of serotonin by the pre-synaptic transporter. Inhibition of serotonin recycling enhances serotonergic function through serotonin accumulation in the synaptic cleft, which resulting in long-term desensitization and downregulation of 5HT1 (serotonin) receptors and leading to symptomatic relief of depressive illness.

CAS Number217797-14-3
PubChem CID9845306
IUPAC Name(3S,4R)-3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)piperidine;methanesulfonic acid
Molecular FormulaC20H24FNO6S
Molecular Weight425.5
Topological Polar Surface Area102
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count29
Formal Charge0
Complexity495
SMILES
CS(=O)(=O)O.C1CNC[C@H]([C@@H]1C2=CC=C(C=C2)F)COC3=CC4=C(C=C3)OCO4
InChI
InChI=1S/C19H20FNO3.CH4O3S/c20-15-3-1-13(2-4-15)17-7-8-21-10-14(17)11-22-16-5-6-18-19(9-16)24-12-23-18;1-5(2,3)4/h1-6,9,14,17,21H,7-8,10-12H2;1H3,(H,2,3,4)/t14-,17-;/m0./s1
InChIKey
SHIJTGJXUHTGGZ-RVXRQPKJSA-N
Chemical Structure
2D Structure
2D structure of Paroxetine Mesylate
CAS: 217797-14-3
CID: 9845306
Formula: C20H24FNO6S
MW: 425.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight425.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass425.13083682
Monoisotopic Mass425.13083682
Topological Polar Surface Area102 Ų
Heavy Atom Count29
Formal Charge0
Complexity495
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