APALUTAMIDE

Apalutamide is an androgenreceptor inhibitor used in nonmetastatic and metastatic prostate cancer, preventing AR nuclear translocation. Side effects include fatigue, rash, fractures, hypothyroidism, and hypertension. Only GMP materials will be supplied, logistics all according to GDP.

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Product Description


Mechanism of Action

APALUTAMIDE demonstrates a highdimensional biochemical activity framework integrating catalyticdomain modulation, multiaxis signalling interference, mitochondrialnetwork recalibration, redoxequilibrium restructuring, ionflux redistribution, membranepotential modulation, cytoskeletalarchitecture remodelling and transcriptionfactor circuit reprogramming. The compounds molecular topology supports interaction with catalytic residues, allosteric microdomains, transmembrane helices, nucleotidebinding pockets, redoxbuffer matrices and polymeric scaffolding complexesenabling influence across metabolic, genomic, structural and electrophysiological systems.

APALUTAMIDE may alter phosphorylationflow geometry across ERK, MAPK, JNK, p38 and PI3KAKT axes; reconfigure Gprotein signalstate logic; redistribute Ca²⁺ microdomains; adjust IP/DAG signalling topology; and recalibrate cAMPPKA amplitude. Mitochondrial effects include ETCcomplex rebalancing, ATP/ADP flux modulation, ROSthreshold displacement, membranepotential polarity shifting, and ERmitochondria stresssignal crosstalk integration.

HighPrecision

  • Kinomescale interference mapping & catalyticcascade modelling
  • Highresolution molecular docking & conformationaltransition prediction
  • UPR/ERstress, mitophagy & autophagicflux regulatory modelling
  • Multiomics network reconstruction: RNAseq, metabolomics, proteomics, phosphoproteomics
  • Cytoskeletal tensionmapping & polymerturnover analytics
  • Advanced cellfate pathway modelling (apoptosis, necroptosis, ferroptosis, parthanatos)
  • AIdriven SAR/QSAR predictive compoundperformance optimisation

Toxicodynamics & Hazard Spectrum

  • Rapid ROS escalation & antioxidantbuffer collapse
  • Mitochondrial fragmentation or ETCaxis suppression
  • Severe Na⁺/K⁺/Ca²⁺ ionic-flux destabilisation
  • Cytoskeletal depolymerisation & membrane-integrity loss
  • Inflammatory hyperactivation (NF-κB, STAT, IRF signalling clusters)
  • Activation of multiaxis programmed-cell-death pathways
  • Epigenetic drift including methylation/acetylation instability

For expert not intended for biological or therapeutic exposure.

Only GMP materials will be supplied, logistics all according to GDP.

Datasheet


Molecular Formula

C21H15F7N2O2

Molecular Weight

477.4 g/mol

CAS Number

956104-40-8

Storage Condition

Store in a cool, dry place. Keep container tightly closed. Protect from moisture and light.

Solubility

practically insoluble in aqueous media

Purity

Purity information is available upon request (COA).

Synonym

apalutamide; ARN-509; 956104-40-8; ARN 509; Erleada

IUPAC/Chemical Name

4-[7-[6-cyano-5-(trifluoromethyl)-3-pyridinyl]-8-oxo-6-sulfanylidene-5,7-diazaspiro[3.4]octan-5-yl]-2-fluoro-N-methylbenzamide

InChl Key

HJBWBFZLDZWPHF-UHFFFAOYSA-N

InChl Code

InChI=1S/C21H15F4N5O2S/c1-27-17(31)13-4-3-11(8-15(13)22)30-19(33)29(18(32)20(30)5-2-6-20)12-7-14(21(23,24)25)16(9-26)28-10-12/h3-4,7-8,10H,2,5-6H2,1H3,(H,27,31)

References

https://pubchem.ncbi.nlm.nih.gov/compound/24872560;

3D Conformer.

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