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Pirenperone

CAT: 1410-M19076-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M19076-02Size:5 mg
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Description
Pirenperone is a putative 5-HT2 receptor antagonist with the central antiserotonergic and antidopaminergic action.
CAS Number
75444-65-4
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
393.45
Molecular Formula
C23H24FN3O2
Notes
Research use only, not for human use.
Receptor
5-HT2

Chemical Information

Pirenperone

3-[2-[4-[(4-fluorophenyl)-oxomethyl]-1-piperidinyl]ethyl]-2-methyl-4-pyrido[1,2-a]pyrimidinone is an aromatic ketone.

CAS Number75444-65-4
PubChem CID4847
IUPAC Name3-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-2-methylpyrido[1,2-a]pyrimidin-4-one
Molecular FormulaC23H24FN3O2
Molecular Weight393.5
XLogP2.6
Topological Polar Surface Area53
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count29
Formal Charge0
Complexity782
SMILES
CC1=C(C(=O)N2C=CC=CC2=N1)CCN3CCC(CC3)C(=O)C4=CC=C(C=C4)F
InChI
InChI=1S/C23H24FN3O2/c1-16-20(23(29)27-12-3-2-4-21(27)25-16)11-15-26-13-9-18(10-14-26)22(28)17-5-7-19(24)8-6-17/h2-8,12,18H,9-11,13-15H2,1H3
InChIKey
HXCNRYXBZNHDNE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pirenperone
CAS: 75444-65-4
CID: 4847
Formula: C23H24FN3O2
MW: 393.5
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight393.5
XLogP32.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass393.18525518
Monoisotopic Mass393.18525518
Topological Polar Surface Area53 Ų
Heavy Atom Count29
Formal Charge0
Complexity782
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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