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Remoxipride

CAT: 0013-GTR19196641-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19196641-01Size:25 mg
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Description
Remoxipride is a selective dopamine D2 receptor antagonist used as an antipsychotic in research. It is applied in neuroscience studies for investigating dopaminergic pathways and has been utilized in both in vitro receptor binding assays and in vivo behavioral models.
CAS Number
80125-14-0
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
C (NC[C@H]1N (CC) CCC1) (=O) C2=C (OC) C (Br) =CC=C2OC
Molecular Formula
C16H23BrN2O3
Molecular Weight
371.27
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Remoxipride

3-bromo-N-[[(2S)-1-ethyl-2-pyrrolidinyl]methyl]-2,6-dimethoxybenzamide is a dimethoxybenzene.

CAS Number80125-14-0
PubChem CID54477
IUPAC Name3-bromo-N-[[(2S)-1-ethylpyrrolidin-2-yl]methyl]-2,6-dimethoxybenzamide
Molecular FormulaC16H23BrN2O3
Molecular Weight371.27
XLogP2.1
Topological Polar Surface Area50.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Heavy Atom Count22
Formal Charge0
Complexity369
SMILES
CCN1CCC[C@H]1CNC(=O)C2=C(C=CC(=C2OC)Br)OC
InChI
InChI=1S/C16H23BrN2O3/c1-4-19-9-5-6-11(19)10-18-16(20)14-13(21-2)8-7-12(17)15(14)22-3/h7-8,11H,4-6,9-10H2,1-3H3,(H,18,20)/t11-/m0/s1
InChIKey
GUJRSXAPGDDABA-NSHDSACASA-N
Chemical Structure
2D Structure
2D structure of Remoxipride
CAS: 80125-14-0
CID: 54477
Formula: C16H23BrN2O3
MW: 371.27
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight371.27
XLogP32.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count6
Exact Mass370.08921
Monoisotopic Mass370.08921
Topological Polar Surface Area50.8 Ų
Heavy Atom Count22
Formal Charge0
Complexity369
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