Products for Research Use Only

RU 58642

CAT: 0013-GTR19198557-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19198557-01Size:25 mg
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Description
RU 58642 is a potent nonsteroidal antiandrogen used in research to study androgen-dependent conditions. It effectively inhibits androgen receptor signaling and has been utilized in both in vitro binding assays and in vivo models of prostate cancer and androgenetic alopecia.
CAS Number
143782-63-2
Field of Research
Metabolism Research
Smiles
O=C1N (C (=O) C (C) (C) N1CC#N) C2=CC (C (F) (F) F) =C (C#N) C=C2
Molecular Formula
C15H11F3N4O2
Molecular Weight
336.27
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

3-(4-Cyano-3-(trifluoromethyl)phenyl)-5,5-dimethyl-2,4-dioxo-1-imidazolidineacetonitrile

structure in first source

CAS Number143782-63-2
PubChem CID9840708
IUPAC Name4-[3-(cyanomethyl)-4,4-dimethyl-2,5-dioxoimidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile
Molecular FormulaC15H11F3N4O2
Molecular Weight336.27
XLogP1.9
Topological Polar Surface Area88.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count2
Heavy Atom Count24
Formal Charge0
Complexity655
SMILES
CC1(C(=O)N(C(=O)N1CC#N)C2=CC(=C(C=C2)C#N)C(F)(F)F)C
InChI
InChI=1S/C15H11F3N4O2/c1-14(2)12(23)22(13(24)21(14)6-5-19)10-4-3-9(8-20)11(7-10)15(16,17)18/h3-4,7H,6H2,1-2H3
InChIKey
ZVWXHSNUBLIKJH-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-(4-Cyano-3-(trifluoromethyl)phenyl)-5,5-dimethyl-2,4-dioxo-1-imidazolidineacetonitrile
CAS: 143782-63-2
CID: 9840708
Formula: C15H11F3N4O2
MW: 336.27
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight336.27
XLogP31.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count2
Exact Mass336.08341009
Monoisotopic Mass336.08341009
Topological Polar Surface Area88.2 Ų
Heavy Atom Count24
Formal Charge0
Complexity655
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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