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Cimoxatone

CAT: 0931-T25252-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T25252-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
73815-11-9
Target
Others, Monoamine Oxidase
Related Pathways
Others, Neuroscience
Bioactivity
Cimoxatone is used as a Monoamine Oxidase Inhibitor.
Smiles
O=C1N(CC(COC)O1)C2=CC=C(OCC3=CC(C#N)=CC=C3)C=C2
Molecular Formula
C19H18N2O4
Molecular Weight
338.36
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Cimoxatone
CAS Number73815-11-9
PubChem CID52542
IUPAC Name3-[[4-[5-(methoxymethyl)-2-oxo-1,3-oxazolidin-3-yl]phenoxy]methyl]benzonitrile
Molecular FormulaC19H18N2O4
Molecular Weight338.4
XLogP2.6
Topological Polar Surface Area71.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count25
Formal Charge0
Complexity495
SMILES
COCC1CN(C(=O)O1)C2=CC=C(C=C2)OCC3=CC(=CC=C3)C#N
InChI
InChI=1S/C19H18N2O4/c1-23-13-18-11-21(19(22)25-18)16-5-7-17(8-6-16)24-12-15-4-2-3-14(9-15)10-20/h2-9,18H,11-13H2,1H3
InChIKey
MVVJINIUPYKZHR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Cimoxatone
CAS: 73815-11-9
CID: 52542
Formula: C19H18N2O4
MW: 338.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight338.4
XLogP32.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass338.12665706
Monoisotopic Mass338.12665706
Topological Polar Surface Area71.8 Ų
Heavy Atom Count25
Formal Charge0
Complexity495
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
HY-15386Cimoxatone

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