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Inaperisone

CAT: 0013-GTR19213078-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19213078-01Size:1 mg
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Description
Inaperisone is a centrally acting muscle relaxant that suppresses the voiding reflex, potentially via indirect action on brainstem GABAB receptors. It is used in research to study urinary dysfunction and neuropharmacology, with applications in both in vivo and in vitro experimental models.
CAS Number
99323-21-4
Product Name Alternative
GABAReceptor, GABA Receptor
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Purity
98.83% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (8.15 mM) ; DMSO:50 mg/mL (203.78 mM)
Smiles
C (C (CN1CCCC1) C) (=O) C2=CC=C (CC) C=C2
Molecular Formula
C16H23NO
Molecular Weight
245.36
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1-(4-Ethylphenyl)-2-methyl-3-(1-pyrrolidinyl)-1-propanone

Inaperisone is an aromatic ketone.

CAS Number99323-21-4
PubChem CID65860
IUPAC Name1-(4-ethylphenyl)-2-methyl-3-pyrrolidin-1-ylpropan-1-one
Molecular FormulaC16H23NO
Molecular Weight245.36
XLogP3.4
Topological Polar Surface Area20.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Heavy Atom Count18
Formal Charge0
Complexity262
SMILES
CCC1=CC=C(C=C1)C(=O)C(C)CN2CCCC2
InChI
InChI=1S/C16H23NO/c1-3-14-6-8-15(9-7-14)16(18)13(2)12-17-10-4-5-11-17/h6-9,13H,3-5,10-12H2,1-2H3
InChIKey
VNFAARJCGSAROU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(4-Ethylphenyl)-2-methyl-3-(1-pyrrolidinyl)-1-propanone
CAS: 99323-21-4
CID: 65860
Formula: C16H23NO
MW: 245.36
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight245.36
XLogP33.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count5
Exact Mass245.177964357
Monoisotopic Mass245.177964357
Topological Polar Surface Area20.3 Ų
Heavy Atom Count18
Formal Charge0
Complexity262
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-128469-01Inaperisone

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