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Apalutamide-[d3]

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General Information
Catalog: BLP-003319
CAS: 1638885-61-6
Molecular Formula: C21H12D3F4N5O2S
Molecular Weight: 480.45

Chemical Structure

Description	Apalutamide-[d3] is an isotope analogue of Apalutamide which is a potent and competitive androgen receptor (AR) antagonist with potential antineoplastic activity. It binds to AR in target tissues thereby preventing androgen-induced receptor activation and facilitating the formation of inactive complexes that cannot be translocated to the nucleus.
Synonyms	4-[7-[6-Cyano-5-(trifluoromethyl)-3-pyridinyl]-8-oxo-6-thioxo-5,7-diazaspiro[3.4]oct-5-yl]-2-fluoro-N-(methyl-d3)-benzamide
IUPAC Name	4-[7-[6-cyano-5-(trifluoromethyl)pyridin-3-yl]-8-oxo-6-sulfanylidene-5,7-diazaspiro[3.4]octan-5-yl]-2-fluoro-N-(trideuteriomethyl)benzamide
Related CAS	956104-40-8 (unlabelled)
Canonical SMILES	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)/i1D3
InChI Key	HJBWBFZLDZWPHF-FIBGUPNXSA-N
Purity	> 98%