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CD3254

CAT: 0931-T14912Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T14912Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
196961-43-0
Target
Retinoid Receptor
Related Pathways
Metabolism
Purity
0.9871
Bioactivity
CD3254 is a selective and potent retinoid X receptor-like (RXR) agonist that inhibits neuronal cell death with OGD/reoxygenation.
Smiles
Cc1cc2c(cc1-c1cc(\C=C/C(O)=O)ccc1O)C(C)(C)CCC2(C)C
Molecular Formula
C24H28O3
Molecular Weight
364.48
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

CD3254

structure in first source

CAS Number196961-43-0
PubChem CID44566110
IUPAC Name(E)-3-[4-hydroxy-3-(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)phenyl]prop-2-enoic acid
Molecular FormulaC24H28O3
Molecular Weight364.5
XLogP6.6
Topological Polar Surface Area57.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count27
Formal Charge0
Complexity576
SMILES
CC1=CC2=C(C=C1C3=C(C=CC(=C3)/C=C/C(=O)O)O)C(CCC2(C)C)(C)C
InChI
InChI=1S/C24H28O3/c1-15-12-19-20(24(4,5)11-10-23(19,2)3)14-17(15)18-13-16(6-8-21(18)25)7-9-22(26)27/h6-9,12-14,25H,10-11H2,1-5H3,(H,26,27)/b9-7+
InChIKey
DYLLZSVPAUUSSB-VQHVLOKHSA-N
Chemical Structure
2D Structure
2D structure of CD3254
CAS: 196961-43-0
CID: 44566110
Formula: C24H28O3
MW: 364.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight364.5
XLogP36.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass364.20384475
Monoisotopic Mass364.20384475
Topological Polar Surface Area57.5 Ų
Heavy Atom Count27
Formal Charge0
Complexity576
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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CatalogName
BUP22014CD3254

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