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Ralaniten

CAT: 1410-M10744-01Size: 1 mL x 10 mM in DMSODry Ice: NoHazardous: No
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CAT#:1410-M10744-01Size:1 mL x 10 mM in DMSO
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
Ralaniten (EPI-506) is a novel small-molecule inhibitor of androgen receptor (AR) N-terminal domain inhibitor for the treatment of advanced prostate cancer.
CAS Number
1203490-23-6
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
394.89
Molecular Formula
C21H27ClO5
Notes
Research use only, not for human use.
Receptor
Estrogen Receptor/ERR

Chemical Information

Ralaniten

Ralaniten is a small molecule drug. Ralaniten has a monoisotopic molecular weight of 394.15 Da.

CAS Number1203490-23-6
PubChem CID45107537
IUPAC Name(2R)-3-[4-[2-[4-[(2S)-3-chloro-2-hydroxypropoxy]phenyl]propan-2-yl]phenoxy]propane-1,2-diol
Molecular FormulaC21H27ClO5
Molecular Weight394.9
XLogP3.3
Topological Polar Surface Area79.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count10
Heavy Atom Count27
Formal Charge0
Complexity403
SMILES
CC(C)(C1=CC=C(C=C1)OC[C@@H](CO)O)C2=CC=C(C=C2)OC[C@@H](CCl)O
InChI
InChI=1S/C21H27ClO5/c1-21(2,15-3-7-19(8-4-15)26-13-17(24)11-22)16-5-9-20(10-6-16)27-14-18(25)12-23/h3-10,17-18,23-25H,11-14H2,1-2H3/t17-,18-/m1/s1
InChIKey
HDTYUHNZRYZEEB-QZTJIDSGSA-N
Chemical Structure
2D Structure
2D structure of Ralaniten
CAS: 1203490-23-6
CID: 45107537
Formula: C21H27ClO5
MW: 394.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight394.9
XLogP33.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count10
Exact Mass394.1547017
Monoisotopic Mass394.1547017
Topological Polar Surface Area79.2 Ų
Heavy Atom Count27
Formal Charge0
Complexity403
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
T28502-01Ralaniten
MQC57304-01Ralaniten acetate
GTR19191466-01Ralaniten triacetate

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