4-Desacetamido-4-chloro Andarine - CAS 541497-92-1

Catalog:	BB068454
Product Name:	4-Desacetamido-4-chloro Andarine
CAS:	541497-92-1
Synonyms:	(2S)-3-(4-Chlorophenoxy)-2-hydroxy-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide; SARM S-9

Technical Data

IUPAC Name:	(2S)-3-(4-chlorophenoxy)-2-hydroxy-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide
Description:	4-Desacetamido-4-chloro Andarine is a Selective Androgen Receptor Modulator (SARM) that has potential use for treatment of androgen related diseases such as muscle wasting and osteoporosis. 4-Desacetamido-4-chloro Andarine also a derivative of Andarine (A637470), a non-steroidal SARM that is used by athletes to enhance performance.
Molecular Weight:	418.75
Molecular Formula:	C17H14ClF3N2O5
Canonical SMILES:	CC(COC1=CC=C(C=C1)Cl)(C(=O)NC2=CC(=C(C=C2)[N+](=O)[O-])C(F)(F)F)O
InChI:	InChI=1S/C17H14ClF3N2O5/c1-16(25,9-28-12-5-2-10(18)3-6-12)15(24)22-11-4-7-14(23(26)27)13(8-11)17(19,20)21/h2-8,25H,9H2,1H3,(H,22,24)/t16-/m0/s1
InChI Key:	GCSIIFZPNSLSLB-INIZCTEOSA-N
Melting Point:	>44°C (dec.)
Solubility:	Chloroform (Slightly), Methanol (Slightly)
Appearance:	Pale Yellow to Yellow Solid
Storage:	-20°C, Hygroscopic
References:	Jones, A., et al. Endocrinology, 150, 385 (2009); Marhefka, C., et al. J. Med. Chem., 47, 993 (2004); Thomas, A., et al. Rapid Comm. Mass Spec., 24, 1124 (2010).

Complexity:	566
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	1
Defined Bond Stereocenter Count:	0
Exact Mass:	418.0543337
Formal Charge:	0
Heavy Atom Count:	28
Hydrogen Bond Acceptor Count:	8
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	418.0543337
Rotatable Bond Count:	5
Topological Polar Surface Area:	104Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.7