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Hyzetimibe

CAT: 0013-GTR19197510-03Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19197510-03Size:25 mg
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Description
Hyzetimibe is a small molecule inhibitor of cholesterol absorption, utilized in research for studying hypercholesterolemia. It is applied in both in vitro assays and in vivo animal models to investigate lipid metabolism and potential anti-atherosclerotic therapies.
CAS Number
1266548-75-7
Smiles
C (/C=C (/CO) \C1=CC=C (F) C=C1) [C@@H]2[C@H] (N (C2=O) C3=CC=C (F) C=C3) C4=CC=C (O) C=C4
Molecular Formula
C25H21F2NO3
Molecular Weight
421.44
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

CID 68162015
CAS Number1266548-75-7
PubChem CID68162015
IUPAC Name(3R,4S)-1-(4-fluorophenyl)-3-[(E)-3-(4-fluorophenyl)-4-hydroxybut-2-enyl]-4-(4-hydroxyphenyl)azetidin-2-one
Molecular FormulaC25H21F2NO3
Molecular Weight421.4
XLogP4.4
Topological Polar Surface Area60.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count31
Formal Charge0
Complexity633
SMILES
C1=CC(=CC=C1[C@@H]2[C@H](C(=O)N2C3=CC=C(C=C3)F)C/C=C(/CO)\C4=CC=C(C=C4)F)O
InChI
InChI=1S/C25H21F2NO3/c26-19-6-1-16(2-7-19)18(15-29)5-14-23-24(17-3-12-22(30)13-4-17)28(25(23)31)21-10-8-20(27)9-11-21/h1-13,23-24,29-30H,14-15H2/b18-5-/t23-,24-/m1/s1
InChIKey
HEHHPZYUXSFAPV-GLGQCLCGSA-N
Chemical Structure
2D Structure
2D structure of CID 68162015
CAS: 1266548-75-7
CID: 68162015
Formula: C25H21F2NO3
MW: 421.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight421.4
XLogP34.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass421.14894986
Monoisotopic Mass421.14894986
Topological Polar Surface Area60.8 Ų
Heavy Atom Count31
Formal Charge0
Complexity633
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-107176AHyzetimibe
HY-107176(E) -Hyzetimibe

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