Betahistine mesylate

CAT: 0127-BUP16444Size: 1 EachDry Ice: NoHazardous: No

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CAT#:0127-BUP16444Size:1 Each

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CAS Number

54856-23-4

Synonyms

Extovyl, Melopat, Meginalisk

Purity

=98%

Smiles

CS(O)(=O)=O.CNCCc1ccccn1

Chemical Information

Betahistine Mesilate

Betahistine mesilate is an aralkylamine.

CAS Number	54856-23-4
PubChem CID	198334
IUPAC Name	methanesulfonic acid;N-methyl-2-pyridin-2-ylethanamine
Molecular Formula	C10H20N2O6S2
Molecular Weight	328.4
Topological Polar Surface Area	150
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	3
Heavy Atom Count	20
Formal Charge	0
Complexity	176

SMILES

CNCCC1=CC=CC=N1.CS(=O)(=O)O.CS(=O)(=O)O

InChI

InChI=1S/C8H12N2.2CH4O3S/c1-9-7-5-8-4-2-3-6-10-8;2*1-5(2,3)4/h2-4,6,9H,5,7H2,1H3;2*1H3,(H,2,3,4)

InChIKey

ZBJJDYGJCNTNTH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 54856-23-4

CID: 198334

Formula: C10H20N2O6S2

MW: 328.4

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	328.4
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	8
Rotatable Bond Count	3
Exact Mass	328.07627871
Monoisotopic Mass	328.07627871
Topological Polar Surface Area	150 Å²
Heavy Atom Count	20
Formal Charge	0
Complexity	176
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	3
Compound Is Canonicalized	Yes

Catalog	Name
BUP16747	Betahistine
BUP18938	Betahistine dihydrochloride
OR1012385-01	Betahistine Dihydrochloride
OR1032795-01	Betahistine EP Impurity C
BUP21943	Tetrindole mesylate
PC108819-01	Pefloxacin mesylate
BI12183	Bromocriptine mesylate
BUP06174-01	Nelfinavir Mesylate
BUP03979-01	NSC243928 mesylate
BUP21285-01	Belumosudil mesylate

Catalog	Name
C6391-25	Betahistine mesylate
HY-D0237-01	Betahistine (mesylate)
HY-D0237R-01	Betahistine (mesylate) (Standard)
MBS5750058	Betahistine