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Chemical structure of RD162

GC11957

RD162

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

androgen receptor (AR) antagonist

ChemicalCAS915087-27-3MW476.4FormulaC22H16F4N4O2S
CAS number
915087-27-3
Molecular weight
476.4
Formula
C22H16F4N4O2S
Solubility
≤30mg/ml in DMSO;30mg/ml in dimethyl formamide
InChIKey
JPQFGMYHKSKKGW-UHFFFAOYSA-N
Catalogue number
GC11957
Brand
GLPBIO
Computed properties PubChem CID 11957756 · XLogP 3.7 · TPSA 109 Ų · H-bond donors 1
XLogP
3.7
TPSA
109 Ų
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
3
Heavy atoms
33

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

Computed descriptors from PubChem (CID 11957756), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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