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Lesopitron dihydrochloride

CAT: 0013-GTR19205541-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19205541-01Size:25 mg
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Description
Lesopitron dihydrochloride is a potent and selective full agonist of the 5-HT1A receptor, exhibiting an IC50 of 125 nM in rat hippocampal membrane assays. This compound is a valuable research tool for investigating serotonin receptor function in both in vitro binding studies and in vivo models of anxiety and depression.
CAS Number
132449-89-9
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
Cl.Cl.Clc1cnn (CCCCN2CCN (CC2) c2ncccn2) c1
Molecular Formula
C15H23Cl3N6
Molecular Weight
393.74
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Lesopitron dihydrochloride
CAS Number132449-89-9
PubChem CID60812
IUPAC Name2-[4-[4-(4-chloropyrazol-1-yl)butyl]piperazin-1-yl]pyrimidine;dihydrochloride
Molecular FormulaC15H23Cl3N6
Molecular Weight393.7
Topological Polar Surface Area50.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count24
Formal Charge0
Complexity317
SMILES
C1CN(CCN1CCCCN2C=C(C=N2)Cl)C3=NC=CC=N3.Cl.Cl
InChI
InChI=1S/C15H21ClN6.2ClH/c16-14-12-19-22(13-14)7-2-1-6-20-8-10-21(11-9-20)15-17-4-3-5-18-15;;/h3-5,12-13H,1-2,6-11H2;2*1H
InChIKey
RGDLQJUAYQRGBC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Lesopitron dihydrochloride
CAS: 132449-89-9
CID: 60812
Formula: C15H23Cl3N6
MW: 393.7
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight393.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass392.104978
Monoisotopic Mass392.104978
Topological Polar Surface Area50.1 Ų
Heavy Atom Count24
Formal Charge0
Complexity317
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes

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