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CNO (Clozapine N-oxide)

CAT: 1568-C12292-1gSize: 1 gDry Ice: NoHazardous: No
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CAT#:1568-C12292-1gSize:1 g
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CAS Number
34233-69-7
Target
AChR
Applications
Neuronal Signaling
Smiles
C[N+]1 ([O-]) CCN (CC1) C2=NC3=C (NC4=CC=CC=C24) C=CC (=C3) Cl
Molecular Formula
C18H19ClN4O
Additionnal Information
CNO (Clozapine N-oxide) is a metabolite of Clozapine (GLXC-06516) and an agonist of human muscarinic designer receptors (Designer Receptors Exclusively Activated by Designer Drugs, DREADDs) . Clozapine is a potent dopamine (DA) antagonist and a selective muscarinic M4 receptor agonist.Solutions are unstable and should be fresh-prepared.

Chemical Information

clozapine N-oxide

Clozapine N-oxide is a dibenzodiazepine.

CAS Number34233-69-7
PubChem CID135445691
IUPAC Name3-chloro-6-(4-methyl-4-oxidopiperazin-4-ium-1-yl)-11H-benzo[b][1,4]benzodiazepine
Molecular FormulaC18H19ClN4O
Molecular Weight342.8
XLogP2.5
Topological Polar Surface Area45.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count24
Formal Charge0
Complexity491
SMILES
C[N+]1(CCN(CC1)C2=NC3=C(C=CC(=C3)Cl)NC4=CC=CC=C42)[O-]
InChI
InChI=1S/C18H19ClN4O/c1-23(24)10-8-22(9-11-23)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
InChIKey
OGUCZBIQSYYWEF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of clozapine N-oxide
CAS: 34233-69-7
CID: 135445691
Formula: C18H19ClN4O
MW: 342.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight342.8
XLogP32.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass342.1247389
Monoisotopic Mass342.1247389
Topological Polar Surface Area45.7 Ų
Heavy Atom Count24
Formal Charge0
Complexity491
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

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