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Picenadol

CAT: 0013-GTR19213656-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19213656-02Size:5 mg
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Description
Picenadol (LY 150720) is a racemic N-methyl-4-phenylpiperidine derivative exhibiting mixed opioid agonist-antagonist properties. This small molecule is utilized in pharmacological research for studying central analgesia, with applications in both in vitro receptor binding assays and in vivo models of pain.
CAS Number
2650427-35-1
Product Name Alternative
LY150720, LY-150720, LY 150720, Picenadol
Purity
97.10% (May vary between batches)
Solubility
DMSO:55 mg/mL (222.33 mM)
Smiles
C (CC) C1 (C (C) CN (C) CC1) C2=CC (O) =CC=C2
Molecular Formula
C16H25NO
Molecular Weight
247.38
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Phenol, 3-[(3R,4S)-1,3-dimethyl-4-propyl-4-piperidinyl]-, rel-
CAS Number2650427-35-1
PubChem CID10469079
IUPAC Name3-(1,3-dimethyl-4-propylpiperidin-4-yl)phenol
Molecular FormulaC16H25NO
Molecular Weight247.38
XLogP4.2
Topological Polar Surface Area23.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count18
Formal Charge0
Complexity268
SMILES
CCCC1(CCN(CC1C)C)C2=CC(=CC=C2)O
InChI
InChI=1S/C16H25NO/c1-4-8-16(9-10-17(3)12-13(16)2)14-6-5-7-15(18)11-14/h5-7,11,13,18H,4,8-10,12H2,1-3H3
InChIKey
RTOHPIRUUAKHOZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Phenol, 3-[(3R,4S)-1,3-dimethyl-4-propyl-4-piperidinyl]-, rel-
CAS: 2650427-35-1
CID: 10469079
Formula: C16H25NO
MW: 247.38
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight247.38
XLogP34.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass247.193614421
Monoisotopic Mass247.193614421
Topological Polar Surface Area23.5 Ų
Heavy Atom Count18
Formal Charge0
Complexity268
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
M36214-01Picenadol
HY-106601APicenadol (hydrochloride)

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