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Bexarotene

CAT: 1410-M12167-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1410-M12167-02Size:25 mg
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Description
Bexarotene is a retinoid specifically selective for retinoid X receptors, used as an oral antineoplastic agent in the treatment of cutaneous T-cell lymphoma.
CAS Number
153559-49-0
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
348
Molecular Formula
C24H28O2
Notes
Research use only, not for human use.
Receptor
RXR

Chemical Information

Bexarotene

Bexarotene is a member of benzoic acids, a member of naphthalenes and a retinoid. It has a role as an antineoplastic agent.

CAS Number153559-49-0
PubChem CID82146
IUPAC Name4-[1-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)ethenyl]benzoic acid
Molecular FormulaC24H28O2
Molecular Weight348.5
XLogP7.6
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Heavy Atom Count26
Formal Charge0
Complexity551
SMILES
CC1=CC2=C(C=C1C(=C)C3=CC=C(C=C3)C(=O)O)C(CCC2(C)C)(C)C
InChI
InChI=1S/C24H28O2/c1-15-13-20-21(24(5,6)12-11-23(20,3)4)14-19(15)16(2)17-7-9-18(10-8-17)22(25)26/h7-10,13-14H,2,11-12H2,1,3-6H3,(H,25,26)
InChIKey
NAVMQTYZDKMPEU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bexarotene
CAS: 153559-49-0
CID: 82146
Formula: C24H28O2
MW: 348.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight348.5
XLogP37.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count3
Exact Mass348.208930132
Monoisotopic Mass348.208930132
Topological Polar Surface Area37.3 Ų
Heavy Atom Count26
Formal Charge0
Complexity551
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

Alternative Products

CatalogName
1575-5Bexarotene

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