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Fenspiride HCl

CAT: 0957-S4090Size: 50 mgDry Ice: YesHazardous: No
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CAT#:0957-S4090Size:50 mg
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Description
Fenspiride (Decaspiride) is a bronchodilator with anti-inflammatory properties, inhibiting phosphodiesterase 4 and phosphodiesterase 3 activities with logIC50 values of 4.16 and 3.44, respectively, in human isolated bronchi.
CAS Number
5053-08-7
Synonyms
Decaspiride
Target
PDE
Activity
Metabolism
Molecular Formula
C15H20N2O2.HCl
Storage Conditions
2 years -80 in solvent

Chemical Information

Fenspiride Hydrochloride

See also: Fenspiride (has active moiety).

CAS Number5053-08-7
PubChem CID68626
IUPAC Name8-(2-phenylethyl)-1-oxa-3,8-diazaspiro[4.5]decan-2-one;hydrochloride
Molecular FormulaC15H21ClN2O2
Molecular Weight296.79
Topological Polar Surface Area41.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count20
Formal Charge0
Complexity318
SMILES
C1CN(CCC12CNC(=O)O2)CCC3=CC=CC=C3.Cl
InChI
InChI=1S/C15H20N2O2.ClH/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);1H
InChIKey
FIKFLLIUPUVONI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Fenspiride Hydrochloride
CAS: 5053-08-7
CID: 68626
Formula: C15H21ClN2O2
MW: 296.79
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight296.79
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass296.1291556
Monoisotopic Mass296.1291556
Topological Polar Surface Area41.6 Ų
Heavy Atom Count20
Formal Charge0
Complexity318
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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