MedKoo Cat#: 584431 | Name: XY 018
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Description:

WARNING: This product is for research use only, not for human or veterinary use.

XY 018 is a RORγ antagonist that suppresses androgen receptor expression in prostate cancer cell lines and inhibits growth of tumors in androgen receptor-positive xenograft models.

Chemical Structure

XY 018
XY 018
CAS#1873358-87-2

Theoretical Analysis

MedKoo Cat#: 584431

Name: XY 018

CAS#: 1873358-87-2

Chemical Formula: C23H15F7N2O4

Exact Mass: 516.0920

Molecular Weight: 516.37

Elemental Analysis: C, 53.50; H, 2.93; F, 25.75; N, 5.43; O, 12.39

Price and Availability

Size Price Availability Quantity
10mg USD 350.00
50mg USD 990.00
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Related CAS #
No Data
Synonym
XY 018; XY018; XY-018
IUPAC/Chemical Name
N-[2'-Fluoro-4'-[2,2,2-trifluoro-1-hydroxy-1-(trifluoromethyl)ethyl][1,1'biphenyl]-4-yl]-2-nitrobenzeneacetamide
InChi Key
MNVXADPCMINSEC-UHFFFAOYSA-N
InChi Code
InChI=1S/C23H15F7N2O4/c24-18-12-15(21(34,22(25,26)27)23(28,29)30)7-10-17(18)13-5-8-16(9-6-13)31-20(33)11-14-3-1-2-4-19(14)32(35)36/h1-10,12,34H,11H2,(H,31,33)
SMILES Code
O=C(NC1=CC=C(C2=CC=C(C(C(F)(F)F)(O)C(F)(F)F)C=C2F)C=C1)CC3=CC=CC=C3[N+]([O-])=O
Appearance
Solid powder
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
Soluble in DMSO
Shelf Life
>2 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.09.01
More Info
Certificate of Analysis
Safety Data Sheet (SDS)

Preparing Stock Solutions

The following data is based on the product molecular weight 516.37 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
Wang et al (2016) ROR-γ drives androgen receptor expression and represents a therapeutic target in castration-resistant prostate cancer. Nat.Med. 22 488 PMID: 27019329 Ndagi et al (2016) Re-emergence of an orphan therapeutic target for the treatment of resistant prostate cancer - a through conformational and binding analysis for RORγ protein. J.Biomol.Struct.Dyn. 36 1