Products for Research Use Only
RegisterLogin

RU 59063

CAT: 0013-GTR19216598-01Size: 1 gDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19216598-01Size:1 g
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
RU 59063 is a prototype of a new class of high-affinity nonsteroidal androgen receptor (AR) ligands.
CAS Number
155180-53-3
Purity
>98% (HPLC)
Smiles
CC1 (C) N (CCCCO) C (=S) N (C1=O) c1ccc (C#N) c (c1) C (F) (F) F
Molecular Formula
C17H18F3N3O2S
Molecular Weight
385.41
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

RU 59063

a non-steroidal antiandrogen; structure given in first source

CAS Number155180-53-3
PubChem CID197655
IUPAC Name4-[3-(4-hydroxybutyl)-4,4-dimethyl-5-oxo-2-sulfanylideneimidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile
Molecular FormulaC17H18F3N3O2S
Molecular Weight385.4
XLogP2.7
Topological Polar Surface Area99.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count26
Formal Charge0
Complexity614
SMILES
CC1(C(=O)N(C(=S)N1CCCCO)C2=CC(=C(C=C2)C#N)C(F)(F)F)C
InChI
InChI=1S/C17H18F3N3O2S/c1-16(2)14(25)23(15(26)22(16)7-3-4-8-24)12-6-5-11(10-21)13(9-12)17(18,19)20/h5-6,9,24H,3-4,7-8H2,1-2H3
InChIKey
FIDNKDVRTLFETI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of RU 59063
CAS: 155180-53-3
CID: 197655
Formula: C17H18F3N3O2S
MW: 385.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight385.4
XLogP32.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass385.10718249
Monoisotopic Mass385.10718249
Topological Polar Surface Area99.7 Ų
Heavy Atom Count26
Formal Charge0
Complexity614
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

Related Products

CatalogName
GTR19202105-01RU 23686
GTR19274935-01RU 56279
GTR19198566-01RU 25434
GTR19198563-01RU 41656
GTR19197446-01RU-0207148
GTR19192808-01RU 45196
GTR19200899-01RU 58668
GTR19198557-01RU 58642
GTR19198555-01RU-39411
GTR19192809-01RU 34030

Alternative Products

CatalogName
T20761-01RU 59063

Popular Products