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Peraclopone

CAT: 0013-GTR19211664-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19211664-03Size:100 mg
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Description
Peraclopone is a hypolipidemic research compound that potently inhibits 7-dehydrocholesterol reductase, the final enzyme in cholesterol biosynthesis. Its application in rodent studies induces a marked replacement of membrane cholesterol with 7-dehydrocholesterol, reducing plasma sterols and altering membrane fluidity in tissues like the intestinal microvillus. This model is used to investigate sterol metabolism, vitamin D synthesis, and membrane biophysics.
CAS Number
96164-19-1
Smiles
ClC1=C (N2CCN (CC (CO/N=C/C3=CC=C (Cl) C=C3) O) CC2) C=CC=C1
Molecular Formula
C20H23Cl2N3O2
Molecular Weight
408.32
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Peraclopone
CAS Number96164-19-1
PubChem CID9576876
IUPAC Name1-[(E)-(4-chlorophenyl)methylideneamino]oxy-3-[4-(2-chlorophenyl)piperazin-1-yl]propan-2-ol
Molecular FormulaC20H23Cl2N3O2
Molecular Weight408.3
XLogP4.2
Topological Polar Surface Area48.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count27
Formal Charge0
Complexity453
SMILES
C1CN(CCN1CC(CO/N=C/C2=CC=C(C=C2)Cl)O)C3=CC=CC=C3Cl
InChI
InChI=1S/C20H23Cl2N3O2/c21-17-7-5-16(6-8-17)13-23-27-15-18(26)14-24-9-11-25(12-10-24)20-4-2-1-3-19(20)22/h1-8,13,18,26H,9-12,14-15H2/b23-13+
InChIKey
IAKCDZCRAWGHFD-YDZHTSKRSA-N
Chemical Structure
2D Structure
2D structure of Peraclopone
CAS: 96164-19-1
CID: 9576876
Formula: C20H23Cl2N3O2
MW: 408.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight408.3
XLogP34.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass407.1167324
Monoisotopic Mass407.1167324
Topological Polar Surface Area48.3 Ų
Heavy Atom Count27
Formal Charge0
Complexity453
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS5810784Peraclopone

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