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Cyclazodone

CAT: 0804-HY-116105-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-116105-01Size:1 mg
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Description
Cyclazodone is a neuroactive compound[1].
CAS Number
14461-91-7
UNSPSC
12352005
Target
Drug Derivative
Related Pathways
Others
Field of Research
Neurological Disease
Smiles
O=C1N=C(OC1C2=CC=CC=C2)NC3CC3
Molecular Formula
C12H12N2O2
Molecular Weight
216.24
References & Citations
[1]Girón AJ, et al. Development and validation of an open screening method for diuretics, stimulants and selected compounds in human urine by UHPLC-HRMS for doping control. Anal Chim Acta. 2012 Apr 6;721:137-46.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
Phase 1

Chemical Information

Cyclazodone
CAS Number14461-91-7
PubChem CID135438121
IUPAC Name2-cyclopropylimino-5-phenyl-1,3-oxazolidin-4-one
Molecular FormulaC12H12N2O2
Molecular Weight216.24
XLogP1.7
Topological Polar Surface Area50.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count16
Formal Charge0
Complexity317
SMILES
C1CC1N=C2NC(=O)C(O2)C3=CC=CC=C3
InChI
InChI=1S/C12H12N2O2/c15-11-10(8-4-2-1-3-5-8)16-12(14-11)13-9-6-7-9/h1-5,9-10H,6-7H2,(H,13,14,15)
InChIKey
DNRKTAYPGADPGW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cyclazodone
CAS: 14461-91-7
CID: 135438121
Formula: C12H12N2O2
MW: 216.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight216.24
XLogP31.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass216.089877630
Monoisotopic Mass216.089877630
Topological Polar Surface Area50.7 Ų
Heavy Atom Count16
Formal Charge0
Complexity317
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
T204469-01Cyclazodone

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