RU58841

CAT: 0957-S5285-03Size: 1 gDry Ice: YesHazardous: No

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CAT#:0957-S5285-03Size:1 g

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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Description

RU58841, also known as PSK-3841 or HMR-3841, is a non-steroidal anti-androgen.

CAS Number

154992-24-2

Synonyms

PSK3841, HMR3841

Target

Androgen Receptor

Activity

Endocrinology & Hormones

Molecular Formula

C17H18F3N3O3

Storage Conditions

2 years -80 in solvent

Chemical Information

4-(3-(4-Hydroxybutyl)-4,4-dimethyl-2,5-dioxo-1-imidazolidinyl)-2-(trifluoromethyl)benzonitrile

a topically active non-steroidal antiandrogen; structure given in first source

CAS Number	154992-24-2
PubChem CID	132981
IUPAC Name	4-[3-(4-hydroxybutyl)-4,4-dimethyl-2,5-dioxoimidazolidin-1-yl]-2-(trifluoromethyl)benzonitrile
Molecular Formula	C17H18F3N3O3
Molecular Weight	369.34
XLogP	2.1
Topological Polar Surface Area	84.6
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	5
Heavy Atom Count	26
Formal Charge	0
Complexity	611

SMILES

CC1(C(=O)N(C(=O)N1CCCCO)C2=CC(=C(C=C2)C#N)C(F)(F)F)C

InChI

InChI=1S/C17H18F3N3O3/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

ARBYGDBJECGMGA-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 154992-24-2

CID: 132981

Formula: C17H18F3N3O3

MW: 369.34

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	369.34
XLogP3	2.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	5
Exact Mass	369.13002593
Monoisotopic Mass	369.13002593
Topological Polar Surface Area	84.6 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	611
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
MBS577533	RU58841