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Clebopride

CAT: 0931-T7569L-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T7569L-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
55905-53-8
Target
Dopamine Receptor, Others
Related Pathways
GPCR/G Protein, Others, Neuroscience
Bioactivity
Clebopride is antidopaminergic. Clebopride also has an effect of antiemetic.
Smiles
C(NC1CCN(CC2=CC=CC=C2)CC1)(=O)C3=C(OC)C=C(N)C(Cl)=C3
Molecular Formula
C20H24ClN3O2
Molecular Weight
373.88
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Clebopride

4-amino-5-chloro-2-methoxy-N-[1-(phenylmethyl)-4-piperidinyl]benzamide is a member of piperidines.

CAS Number55905-53-8
PubChem CID2780
IUPAC Name4-amino-N-(1-benzylpiperidin-4-yl)-5-chloro-2-methoxybenzamide
Molecular FormulaC20H24ClN3O2
Molecular Weight373.9
XLogP3.2
Topological Polar Surface Area67.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count26
Formal Charge0
Complexity450
SMILES
COC1=CC(=C(C=C1C(=O)NC2CCN(CC2)CC3=CC=CC=C3)Cl)N
InChI
InChI=1S/C20H24ClN3O2/c1-26-19-12-18(22)17(21)11-16(19)20(25)23-15-7-9-24(10-8-15)13-14-5-3-2-4-6-14/h2-6,11-12,15H,7-10,13,22H2,1H3,(H,23,25)
InChIKey
BVPWJMCABCPUQY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Clebopride
CAS: 55905-53-8
CID: 2780
Formula: C20H24ClN3O2
MW: 373.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight373.9
XLogP33.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass373.1557047
Monoisotopic Mass373.1557047
Topological Polar Surface Area67.6 Ų
Heavy Atom Count26
Formal Charge0
Complexity450
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