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Org-12962

CAT: 0931-T16401-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T16401-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
132834-56-1
Target
5-HT Receptor
Related Pathways
Neuroscience, GPCR/G Protein
Purity
0.9838
Bioactivity
Org-12962 is an effective and selective 5-HT2C receptor agonist pEC50: 7.01) . Org-12962 shows antiaversive effects in a rat model of panic-like anxiety. Org-12962 also shows high effacy for the 5-HT2A and 5-HT2B receptors (pEC50s: 6.38 and 6.28, respectively) .
Smiles
FC(F)(F)C1=CC=C(N=C1Cl)N1CCNCC1
Molecular Formula
C10H11ClF3N3
Molecular Weight
265.66
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Org 12962
CAS Number132834-56-1
PubChem CID9796408
IUPAC Name1-[6-chloro-5-(trifluoromethyl)-2-pyridinyl]piperazine
Molecular FormulaC10H11ClF3N3
Molecular Weight265.66
XLogP2.5
Topological Polar Surface Area28.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Heavy Atom Count17
Formal Charge0
Complexity256
SMILES
C1CN(CCN1)C2=NC(=C(C=C2)C(F)(F)F)Cl
InChI
InChI=1S/C10H11ClF3N3/c11-9-7(10(12,13)14)1-2-8(16-9)17-5-3-15-4-6-17/h1-2,15H,3-6H2
InChIKey
QZYYPQAYSFBKPW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Org 12962
CAS: 132834-56-1
CID: 9796408
Formula: C10H11ClF3N3
MW: 265.66
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight265.66
XLogP32.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count1
Exact Mass265.0593595
Monoisotopic Mass265.0593595
Topological Polar Surface Area28.2 Ų
Heavy Atom Count17
Formal Charge0
Complexity256
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