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Bepotastine Besilate

CAT: 1568-C17177-10mM/1mLSize: 10 mM/1mLDry Ice: YesHazardous: No
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CAT#:1568-C17177-10mM/1mLSize:10 mM/1mL
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
190786-44-8
Synonyms
TAU 284
Target
Histamine Receptor
Applications
Neuronal Signaling
Smiles
C1CN (CCC1OC (C2=CC=C (C=C2) Cl) C3=CC=CC=N3) CCCC (=O) O.C1=CC=C (C=C1) S (=O) (=O) O
Molecular Formula
C21H25ClN2O3.C6H6O3S
Additionnal Information
Bepotastine Besilate (TAU 284) is a non-sedating, selective antagonist of histamine 1 (H1) receptor with pIC50 of 5.7.
Storage Conditions
2 years -80 in solvent

Chemical Information

Bepotastine Besilate

Bepotastine besylate is an organosulfonate salt obtained by combining equimolar amounts of bepotastine and benzenesulfonic acid. A topical, selective and non-sedating histamine (H1) receptor antagonist used for treatment of itching associated with allergic conjunctivitis. It has a role as a H1-receptor antagonist and an anti-allergic agent. It contains a bepotastine(1+).

CAS Number190786-44-8
PubChem CID164521
IUPAC Namebenzenesulfonic acid;4-[4-[(S)-(4-chlorophenyl)-pyridin-2-ylmethoxy]piperidin-1-yl]butanoic acid
Molecular FormulaC27H31ClN2O6S
Molecular Weight547.1
Topological Polar Surface Area125
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count9
Heavy Atom Count37
Formal Charge0
Complexity632
SMILES
C1CN(CCC1O[C@@H](C2=CC=C(C=C2)Cl)C3=CC=CC=N3)CCCC(=O)O.C1=CC=C(C=C1)S(=O)(=O)O
InChI
InChI=1S/C21H25ClN2O3.C6H6O3S/c22-17-8-6-16(7-9-17)21(19-4-1-2-12-23-19)27-18-10-14-24(15-11-18)13-3-5-20(25)26;7-10(8,9)6-4-2-1-3-5-6/h1-2,4,6-9,12,18,21H,3,5,10-11,13-15H2,(H,25,26);1-5H,(H,7,8,9)/t21-;/m0./s1
InChIKey
UDGHXQPQKQPSBB-BOXHHOBZSA-N
Chemical Structure
2D Structure
2D structure of Bepotastine Besilate
CAS: 190786-44-8
CID: 164521
Formula: C27H31ClN2O6S
MW: 547.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight547.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count9
Exact Mass546.1591356
Monoisotopic Mass546.1591356
Topological Polar Surface Area125 Ų
Heavy Atom Count37
Formal Charge0
Complexity632
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
B1569-200Bepotastine Besilate
HY-A0015-01Bepotastine (besilate)
HY-A0015R-01Bepotastine (besilate) (Standard)
A11340-50Bepotastine Besilate 50mg
HY-A0015A-01(Rac) -Bepotastine (besilate)
A11340-100Bepotastine Besilate 100mg
A11340-500Bepotastine Besilate 500mg
A11340-10mM-DBepotastine Besilate 10mM * 1mL in DMSO
HY-I0021-01Bepotastine

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