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5-HT2C agonist-10

CAT: 0013-GTR19264599-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19264599-01Size:10 mg
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Description
5-HT2C agonist-10 (Compound 21) is a 5-HT2C receptor agonist with an EC50 of less than 10 nM. It is utilized in the study of mental disorders.
CAS Number
3091662-68-6
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
BrC=1C=2C=3N (C[C@@H] (N (C) C) CC3C=CC2) C1
Molecular Formula
C13H15BrN2
Molecular Weight
279.18
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(10S)-3-bromo-N,N-dimethyl-1-azatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-10-amine
CAS Number3091662-68-6
PubChem CID176415137
IUPAC Name(10S)-3-bromo-N,N-dimethyl-1-azatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-10-amine
Molecular FormulaC13H15BrN2
Molecular Weight279.18
XLogP2.8
Topological Polar Surface Area8.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count16
Formal Charge0
Complexity269
SMILES
CN(C)[C@H]1CC2=C3C(=CC=C2)C(=CN3C1)Br
InChI
InChI=1S/C13H15BrN2/c1-15(2)10-6-9-4-3-5-11-12(14)8-16(7-10)13(9)11/h3-5,8,10H,6-7H2,1-2H3/t10-/m0/s1
InChIKey
NOXKHZCLUXLWTH-JTQLQIEISA-N
Chemical Structure
2D Structure
2D structure of (10S)-3-bromo-N,N-dimethyl-1-azatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-10-amine
CAS: 3091662-68-6
CID: 176415137
Formula: C13H15BrN2
MW: 279.18
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight279.18
XLogP32.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass278.04186
Monoisotopic Mass278.04186
Topological Polar Surface Area8.2 Ų
Heavy Atom Count16
Formal Charge0
Complexity269
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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