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Dopamine D2 receptor agonist-2

CAT: 0013-GTR19171859-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19171859-01Size:1 mg
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Description
Dopamine D2 receptor agonist-2 is a selective small molecule ligand for the dopamine D2 receptor. It is utilized in neuroscience research to study receptor function and signaling pathways in both cellular assays and animal models of psychiatric and neurological disorders.
CAS Number
1610591-93-9
Product Name Alternative
Thieno[2,3 b]pyridine 2 carboxamide, 3 amino N [5 [4 (2,3 dichlorophenyl) 1 piperazinyl]pentyl] 4,6 dimethyl, Thieno[2,3b]pyridine2carboxamide, 3aminoN[5[4 (2,3dichlorophenyl) 1piperazinyl]pentyl]4,6dimethyl, DopamineReceptor, Dopamine D2 receptor agonist-2, Dopamine Receptor, D2 receptor
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Purity
98.93% (May vary between batches)
Solubility
DMSO:50 mg/mL (96.06 mM)
Smiles
NC=1C=2C (SC1C (NCCCCCN3CCN (CC3) C4=C (Cl) C (Cl) =CC=C4) =O) =NC (C) =CC2C
Molecular Formula
C25H31Cl2N5OS
Molecular Weight
520.52
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Dopamine D2 receptor agonist-2
CAS Number1610591-93-9
PubChem CID90645289
IUPAC Name3-amino-N-[5-[4-(2,3-dichlorophenyl)piperazin-1-yl]pentyl]-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
Molecular FormulaC25H31Cl2N5OS
Molecular Weight520.5
XLogP6.4
Topological Polar Surface Area103
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Heavy Atom Count34
Formal Charge0
Complexity667
SMILES
CC1=CC(=NC2=C1C(=C(S2)C(=O)NCCCCCN3CCN(CC3)C4=C(C(=CC=C4)Cl)Cl)N)C
InChI
InChI=1S/C25H31Cl2N5OS/c1-16-15-17(2)30-25-20(16)22(28)23(34-25)24(33)29-9-4-3-5-10-31-11-13-32(14-12-31)19-8-6-7-18(26)21(19)27/h6-8,15H,3-5,9-14,28H2,1-2H3,(H,29,33)
InChIKey
YEDOJNFKHXVFHD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dopamine D2 receptor agonist-2
CAS: 1610591-93-9
CID: 90645289
Formula: C25H31Cl2N5OS
MW: 520.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight520.5
XLogP36.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass519.1626372
Monoisotopic Mass519.1626372
Topological Polar Surface Area103 Ų
Heavy Atom Count34
Formal Charge0
Complexity667
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