Apalutamide | CAS No. 956104-40-8

Apalutamide

Basic Information

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CAS Number

956104-40-8

Molecular Formula

C21H15F4N5O2S

Molecular Weight

477.43 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Density

1.59±0.1 g/cm3 (20 ºC 760 Torr),

Solubility

Insuluble (1.3E-3 g/L) (25 ºC),

SMILES

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CNC(=O)C1=C(C=C(C=C1)N2C(=S)N(C(=O)C23CCC3)C4=CC(=C(N=C4)C#N)C(F)(F)F)F

InChI

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)

InChIKey

HJBWBFZLDZWPHF-UHFFFAOYSA-N

LogP

4.05248

Complexity

886

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

ARN-509
ARN 509
4-[7-[6-cyano-5-(trifluoromethyl)pyridin-3-yl]-8-oxo-6-sulfanylidene-5,7-diazaspiro[3.4]octan-5-yl]-2-fluoro-N-methylbenzamide
Apalutamide
AR509
4-(7-(6-Cyano-5-(trifluoromethyl)pyridin-3-yl)-8-oxo-6-thioxo-5,7-diazaspiro(3.4)octan-5-yl)-2-fluoro-N-methylbenzamide
4-[7-(6-cyano-5-trifluoromethylpyridin-3-yl)-8-oxo-6-thioxo-5,7-diazaspiro[3.4]oct-5-yl]-2-fluoro-N-methylbenzamide
4-[7-[6-cyano-5-(trifluoromethyl)pyridin-3-yl]-8-oxo-6-thioxo-5,7-diazaspiro[3.4]octa
Benzamide,4-[7-[6-cyano-5-(trifluoromethyl)-3-pyridinyl]-8-oxo-6-thioxo-5,7-diazaspiro[3.4]oct-5-yl]-2-fluoro-N-methyl
4-[7-[6-Cyano-5-(trifluoromethyl)pyridin-3-yl]-8-oxo-6-thioxo-5,7-diazaspiro[3.4]octan-5-yl]-2-fluoro-N-methylbenzamide
ARN509
4T36H88UA7
4-(7-(6-CYANO-5-(TRIFLUOROMETHYL)PYRIDIN-3-YL)-8-OXO-6-THIOXO-5,7-DIAZASPIRO[3.4]OCTAN-5-YL)-2-FLUORO-N-METHYLBENZAMIDE
Erleada
4-(7-(6-cyano-5-(trifluoroMethyl)pyridin-3-yl)-8-oxo-6-thioxo-5,7-diazaspirooctan-5-yl)-2-fluoro-N-MethylbenzaMide
Apalutamide [INN]
4-{7-[6-cyano-5-(tr
4-[7-[6-Cyano-5-(trifluoromethyl)-3-pyridinyl]-8-oxo-6-thioxo-5,7-diazaspiro[3.4]oct-5-yl]-2-fluoro-N-methylbenzamide (ACI)
A 52
AR 509
Apalutamide(ARN-509)
4-(7-(6-cyano-5-(trifluoromethyl)pyridin-3-yl)-8-oxo-6-thioxo-5,7-diazaspiro[3.4]octan-5-yl)-2-fluoro-N-methylbenzamide
JNJ 56021927
DTXCID20164390
SCHEMBL909297
4-{7-[6-cyano-5-(trifluoromethyl)pyridin-3-yl]-8-oxo-6-sulfanylidene-5,7-diazaspiro[3.4]octan-5-yl}-2-fluoro-N-methylbenzamide
MLS006011109
AC-27403
BENZAMIDE, 4-(7-(6-CYANO-5-(TRIFLUOROMETHYL)-3-PYRIDINYL)-8-OXO-6-THIOXO-5,7-DIAZASPIRO(3.4)OCT-5-YL)-2-FLUORO-N-METHYL-
CHEMBL3183409
NCGC00346725-01

MDL Number

MFCD22380626

FAQ

What is Apalutamide (CAS: 956104-40-8)?

Apalutamide (CAS: 956104-40-8) is a nonsteroidal androgen receptor inhibitor used in the treatment of advanced prostate cancer. It has a molecular formula of C23H27NO4 and is a white to off-white powder with a bitter taste.

What are the main uses of Apalutamide (CAS: 956104-40-8)?

Apalutamide (CAS: 956104-40-8) is primarily used to treat advanced prostate cancer, including non-metastatic castration-resistant prostate cancer (NM-CRPC) and metastatic hormone-sensitive prostate cancer (mHSPC). It is also studied for its potential in other cancer types.

Is Apalutamide (CAS: 956104-40-8) safe?

Apalutamide (CAS: 956104-40-8) is generally considered safe when used as prescribed. However, it can cause side effects such as hot flushes, decreased bone mineral density, and hyperlipidemia. Patients should follow their healthcare provider's advice and take necessary precautions.

How should Apalutamide (CAS: 956104-40-8) be stored?

Apalutamide (CAS: 956104-40-8) should be stored at room temperature (15°C to 30°C), away from moisture and direct sunlight. It should be kept in a tightly sealed container to prevent degradation. Avoid freezing and high temperatures, as these can affect its stability.