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Aligeron

CAT: 0931-T36619-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T36619-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
70713-45-0
Target
Prostaglandin Receptor
Related Pathways
GPCR/G Protein, Immunology/Inflammation
Purity
>99.99%
Bioactivity
Aligeron, a non-selective prostaglandin (PG) antagonist, inhibits PGF2α- and PGE2-induced blood pressure decreases in cats and can prevent PGF2α-induced diarrhea in mice and PGE2-induced paw edema in rats. Additionally, Aligeron is recognized for its antioxidant-protective effect against vascular complications.
Smiles
C=CCN1CCN(CC1)C(C=2C=CC=CC2)C=3C=CC=CC3
Molecular Formula
C20H24N2
Molecular Weight
292.42
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Aligeron

RN given refers to parent cpd; aligeron & AS 2 are for di-HCl

CAS Number70713-45-0
PubChem CID166145
IUPAC Name1-benzhydryl-4-prop-2-enylpiperazine
Molecular FormulaC20H24N2
Molecular Weight292.4
XLogP4.3
Topological Polar Surface Area6.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Heavy Atom Count22
Formal Charge0
Complexity303
SMILES
C=CCN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C20H24N2/c1-2-13-21-14-16-22(17-15-21)20(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h2-12,20H,1,13-17H2
InChIKey
QWGCFVBATALVAQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Aligeron
CAS: 70713-45-0
CID: 166145
Formula: C20H24N2
MW: 292.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight292.4
XLogP34.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass292.193948774
Monoisotopic Mass292.193948774
Topological Polar Surface Area6.5 Ų
Heavy Atom Count22
Formal Charge0
Complexity303
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
VCA71345-01Aligeron
A13241-5Aligeron 5mg
A13241-50Aligeron 50mg
A13241-10Aligeron 10mg
A13241-1Aligeron 1mg

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