Products for Research Use Only

AVN-211

CAT: 0013-GTR19195524-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19195524-01Size:25 mg
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Description
AVN-211 (CD-008-0173) is a potent and selective small molecule antagonist of the 5-HT6 receptor, developed for Alzheimer's disease research. It is utilized in both in vitro binding assays and in vivo behavioral studies to investigate cognitive enhancement and probe the receptor's role in CNS disorders.
CAS Number
1173103-84-8
Smiles
S (=O) (=O) (C1=C2N (N=C1SC) C (C) =CC (C) =N2) C3=CC=CC=C3
Molecular Formula
C15H15N3O2S2
Molecular Weight
333.43
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

5,7-Dimethyl-2-(methylthio)-3-(phenylsulfonyl)pyrazolo(1,5-a)pyrimidine
CAS Number1173103-84-8
PubChem CID44155874
IUPAC Name3-(benzenesulfonyl)-5,7-dimethyl-2-methylsulfanylpyrazolo[1,5-a]pyrimidine
Molecular FormulaC15H15N3O2S2
Molecular Weight333.4
XLogP2.8
Topological Polar Surface Area98
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count22
Formal Charge0
Complexity488
SMILES
CC1=CC(=NC2=C(C(=NN12)SC)S(=O)(=O)C3=CC=CC=C3)C
InChI
InChI=1S/C15H15N3O2S2/c1-10-9-11(2)18-14(16-10)13(15(17-18)21-3)22(19,20)12-7-5-4-6-8-12/h4-9H,1-3H3
InChIKey
KSAUCBGUWGWPDL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5,7-Dimethyl-2-(methylthio)-3-(phenylsulfonyl)pyrazolo(1,5-a)pyrimidine
CAS: 1173103-84-8
CID: 44155874
Formula: C15H15N3O2S2
MW: 333.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight333.4
XLogP32.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass333.06056908
Monoisotopic Mass333.06056908
Topological Polar Surface Area98 Ų
Heavy Atom Count22
Formal Charge0
Complexity488
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