Fenspiride

Identification

Name
Fenspiride
Accession Number
DB08979
Type
Small Molecule
Groups
Experimental
Description

Fenspiride is an oxazolidinone spiro compound used as a drug in the treatment of certain respiratory diseases. It is approved for use in Russia for the treatment of acute and chronic inflammatory diseases of ENT organs and the respiratory tract (like rhinopharyngitis, laryngitis, tracheobronchitis, otitis and sinusitis), as well as for maintenance treatment of asthma.

Structure
Thumb
Synonyms
  • Eurespal
Categories
UNII
S983QC7HKM
CAS number
5053-06-5
Weight
Average: 260.3315
Monoisotopic: 260.152477894
Chemical Formula
C15H20N2O2
InChI Key
FVNFBBAOMBJTST-UHFFFAOYSA-N
InChI
InChI=1S/C15H20N2O2/c18-14-16-12-15(19-14)7-10-17(11-8-15)9-6-13-4-2-1-3-5-13/h1-5H,6-12H2,(H,16,18)
IUPAC Name
8-(2-phenylethyl)-1-oxa-3,8-diazaspiro[4.5]dec-2-en-2-ol
SMILES
OC1=NCC2(CCN(CCC3=CC=CC=C3)CC2)O1

Pharmacology

Indication
Not Available
Pharmacodynamics
Not Available
Mechanism of action
Not Available
Absorption
Not Available
Volume of distribution
Not Available
Protein binding
Not Available
Metabolism
Not Available
Route of elimination
Not Available
Half life
Not Available
Clearance
Not Available
Toxicity
Not Available
Affected organisms
Not Available
Pathways
Not Available
Pharmacogenomic Effects/ADRs
Not Available

Interactions

Drug Interactions
Not Available
Food Interactions
Not Available

References

Synthesis Reference

U.S. Patent 3,399,192.

General References
Not Available
External Links
PubChem Compound
3344
PubChem Substance
310264940
ChemSpider
3227
ChEBI
94558
ChEMBL
CHEMBL576127
Wikipedia
Fenspiride
ATC Codes
R03BX01 — FenspirideR03DX03 — Fenspiride

Clinical Trials

Clinical Trials
Not Available

Pharmacoeconomics

Manufacturers
Not Available
Packagers
Not Available
Dosage forms
Not Available
Prices
Not Available
Patents
Not Available

Properties

State
Solid
Experimental Properties
PropertyValueSource
melting point (°C)232-233U.S. Patent 3,399,192.
Predicted Properties
PropertyValueSource
Water Solubility0.42 mg/mLALOGPS
logP1.81ALOGPS
logP0.98ChemAxon
logS-2.8ALOGPS
pKa (Strongest Acidic)7.99ChemAxon
pKa (Strongest Basic)9.37ChemAxon
Physiological Charge2ChemAxon
Hydrogen Acceptor Count4ChemAxon
Hydrogen Donor Count1ChemAxon
Polar Surface Area45.06 Å2ChemAxon
Rotatable Bond Count3ChemAxon
Refractivity74.52 m3·mol-1ChemAxon
Polarizability29.18 Å3ChemAxon
Number of Rings3ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterYesChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Predicted ADMET features
Not Available

Spectra

Mass Spec (NIST)
Not Available
Spectra
SpectrumSpectrum TypeSplash Key
Predicted GC-MS Spectrum - GC-MSPredicted GC-MSNot Available
Predicted MS/MS Spectrum - 10V, Positive (Annotated)Predicted LC-MS/MSNot Available
Predicted MS/MS Spectrum - 20V, Positive (Annotated)Predicted LC-MS/MSNot Available
Predicted MS/MS Spectrum - 40V, Positive (Annotated)Predicted LC-MS/MSNot Available
Predicted MS/MS Spectrum - 10V, Negative (Annotated)Predicted LC-MS/MSNot Available
Predicted MS/MS Spectrum - 20V, Negative (Annotated)Predicted LC-MS/MSNot Available
Predicted MS/MS Spectrum - 40V, Negative (Annotated)Predicted LC-MS/MSNot Available

Taxonomy

Description
This compound belongs to the class of organic compounds known as azaspirodecane derivatives. These are organic compounds containing a spirodecane moiety with at least one nitrogen atom.
Kingdom
Organic compounds
Super Class
Organoheterocyclic compounds
Class
Azaspirodecane derivatives
Sub Class
Not Available
Direct Parent
Azaspirodecane derivatives
Alternative Parents
Phenethylamines / Aralkylamines / Piperidines / Oxazolidinones / Carbamate esters / Trialkylamines / Organic carbonic acids and derivatives / Oxacyclic compounds / Azacyclic compounds / Organopnictogen compounds
show 3 more
Substituents
Azaspirodecane / Phenethylamine / Aralkylamine / Monocyclic benzene moiety / Oxazolidinone / Piperidine / Benzenoid / Oxazolidine / Carbamic acid ester / Carbonic acid derivative
show 14 more
Molecular Framework
Aromatic heteropolycyclic compounds
External Descriptors
Not Available

Drug created on June 10, 2014 09:23 / Updated on October 01, 2018 14:44