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Picenadol

CAT: 0931-T68127-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T68127-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2650427-35-1
Target
Others
Related Pathways
Others
Purity
0.9804
Bioactivity
Picenadol (LY 150720) is a racemic mixture of N-methyl-4-phenylpiperidine derivatives with agonist-antagonist opioid properties.Picenadol has central analgesic activity.
Smiles
C(CC)C1(C(C)CN(C)CC1)C2=CC(O)=CC=C2
Molecular Formula
C16H25NO
Molecular Weight
247.38
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

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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