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Epinastine

CAT: 0013-GTR19215691-06Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19215691-06Size:500 mg
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Description
Epinastine is a selective, orally active H1 receptor antagonist used to treat allergic conjunctivitis. It also functions as a mast cell stabilizer and inhibits IL-8 release from eosinophils, making it a useful research tool for studying allergic inflammation mechanisms in both in vitro and in vivo models.
CAS Number
80012-43-7
Product Name Alternative
WAL 801, WAL801
Field of Research
Immunology & Inflammation, Neuroscience, Pharmacology & Drug Discovery
Purity
99.94% (May vary between batches)
Solubility
DMSO:≥ 40 mg/mL;10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (8.02 mM) ; H2O:< 1 mg/mL (insoluble)
Smiles
N1=C (N) N2C=3C=CC=CC3CC=4C=CC=CC4C2C1
Molecular Formula
C16H15N3
Molecular Weight
249.31
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Epinastine

Epinastine is a benzazepine that is 6,11-dihydro-5H-dibenzo[b,e]azepine in which the azepine ring is fused to the e side of 4,5-dihydro-1H-imidazol-2-amine. It has a role as a H1-receptor antagonist, a histamine antagonist, an anti-allergic agent and an ophthalmology drug. It is a member of guanidines and a benzazepine.

CAS Number80012-43-7
PubChem CID3241
IUPAC Name2,4-diazatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),3,7,9,11,14,16-heptaen-3-amine
Molecular FormulaC16H15N3
Molecular Weight249.31
XLogP3.5
Topological Polar Surface Area41.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Heavy Atom Count19
Formal Charge0
Complexity378
SMILES
C1C2C3=CC=CC=C3CC4=CC=CC=C4N2C(=N1)N
InChI
InChI=1S/C16H15N3/c17-16-18-10-15-13-7-3-1-5-11(13)9-12-6-2-4-8-14(12)19(15)16/h1-8,15H,9-10H2,(H2,17,18)
InChIKey
WHWZLSFABNNENI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Epinastine
CAS: 80012-43-7
CID: 3241
Formula: C16H15N3
MW: 249.31
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight249.31
XLogP33.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count0
Exact Mass249.126597491
Monoisotopic Mass249.126597491
Topological Polar Surface Area41.6 Ų
Heavy Atom Count19
Formal Charge0
Complexity378
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
448327-01Epinastine
AR-E01488-01Epinastine EP Impurity A (Dehydro Epinastine)
317777Epinastine Hydrochloride
RG-A262022-01Epinastine Impurity A
AR-E01482-01Epinastine HCl
RM-E160900-01Epinastine hydrobromide

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