Products for Research Use Only

Raloxifene

CAT: 0013-GTR19202291-08Size: 200 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19202291-08Size:200 mg
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Description
Raloxifene is a selective estrogen receptor modulator (SERM) with demonstrated antiviral activity against viruses such as Ebola, influenza, and HCV. It is a valuable research tool for studying viral pathogenesis and screening antiviral agents in both in vitro and in vivo experimental models.
CAS Number
84449-90-1
Product Name Alternative
Breast, cancer, bone, osteoporosis, ovariectomized, inhibit, Keoxifene, LY156758, LY-156758, LY156758 free base, LY139481, LY-139481, LY1 39481, LY 156758, LY 139481, loss, ERR, Estrogen Receptor/ERR, EstrogenReceptor, Estrogen Receptor, Inhibitor, SERM, Raloxifene, Raloxifenum, Pharoxifene, rats
Field of Research
Metabolism Research, Pharmacology & Drug Discovery
Purity
99.39% (May vary between batches)
Solubility
Ethanol:9 mg/mL (19 mM) ; DMSO:80 mg/mL (168.93 mM)
Smiles
O=C (C1=CC=C (OCCN2CCCCC2) C=C1) C3=C (SC4=CC (O) =CC=C43) C=5C=CC (O) =CC5
Molecular Formula
C28H27NO4S
Molecular Weight
473.58
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Raloxifene

Raloxifene is a member of the class of 1-benzothiophenes that is 1-benzothiophene in which the hydrogens at positions 2, 3, and 6 have been replaced by p-hydroxyphenyl, p-[2-(piperidin-1-yl)ethoxy]benzoyl, and hydroxy groups, respectively. It has a role as a bone density conservation agent, an estrogen receptor modulator and an estrogen antagonist. It is a member of phenols, a member of 1-benzothiophenes, a N-oxyethylpiperidine and an aromatic ketone. It is a conjugate base of a raloxifene(1+).

CAS Number84449-90-1
PubChem CID5035
IUPAC Name[6-hydroxy-2-(4-hydroxyphenyl)-1-benzothiophen-3-yl]-[4-(2-piperidin-1-ylethoxy)phenyl]methanone
Molecular FormulaC28H27NO4S
Molecular Weight473.6
XLogP6.1
Topological Polar Surface Area98.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Heavy Atom Count34
Formal Charge0
Complexity655
SMILES
C1CCN(CC1)CCOC2=CC=C(C=C2)C(=O)C3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)O
InChI
InChI=1S/C28H27NO4S/c30-21-8-4-20(5-9-21)28-26(24-13-10-22(31)18-25(24)34-28)27(32)19-6-11-23(12-7-19)33-17-16-29-14-2-1-3-15-29/h4-13,18,30-31H,1-3,14-17H2
InChIKey
GZUITABIAKMVPG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Raloxifene
CAS: 84449-90-1
CID: 5035
Formula: C28H27NO4S
MW: 473.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight473.6
XLogP36.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count7
Exact Mass473.16607952
Monoisotopic Mass473.16607952
Topological Polar Surface Area98.2 Ų
Heavy Atom Count34
Formal Charge0
Complexity655
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