ZINC17167211

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

MedKoo CAT#: 562664

CAS#: 592539-21-4 (non-specific stereomer)

Description: ZINC17167211 is a selective agonist of peroxisome proliferator activated receptors-α (PPAR-α).


Chemical Structure

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ZINC17167211
CAS# 592539-21-4 (non-specific stereomer)

Theoretical Analysis

MedKoo Cat#: 562664
Name: ZINC17167211
CAS#: 592539-21-4 (non-specific stereomer)
Chemical Formula: C24H17FN2O6S
Exact Mass: 480.0791
Molecular Weight: 480.46
Elemental Analysis: C, 60.00; H, 3.57; F, 3.95; N, 5.83; O, 19.98; S, 6.67

Price and Availability

This product is not in stock, which may be available by custom synthesis. For cost-effective reason, minimum order is 1g (price is usually high, lead time is 2~3 months, depending on the technical challenge). Quote less than 1g will not be provided. To request quote, please email to sales @medkoo.com or click below button.
Note: Price will be listed if it is available in the future.

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Synonym: ZINC17167211; ZINC-17167211; ZINC 17167211;

IUPAC/Chemical Name: 3-[5-[(Z)-[3-[2-(4-fluoroanilino)-2-oxoethyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]furan-2-yl]-2-methylbenzoic acid

InChi Key: RWPIODBMAVXTEP-JAIQZWGSSA-N

InChi Code: InChI=1S/C24H17FN2O6S/c1-13-17(3-2-4-18(13)23(30)31)19-10-9-16(33-19)11-20-22(29)27(24(32)34-20)12-21(28)26-15-7-5-14(25)6-8-15/h2-11H,12H2,1H3,(H,26,28)(H,30,31)/b20-11-

SMILES Code: O=C(O)C1=CC=CC(C2=CC=C(/C=C(SC(N3CC(NC4=CC=C(F)C=C4)=O)=O)/C3=O)O2)=C1C

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: 2934.99.9001

Preparing Stock Solutions

The following data is based on the product molecular weight 480.46 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

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1: Li J, Wang H, Li J, Bao J, Wu C. Discovery of a Potential HER2 Inhibitor from Natural Products for the Treatment of HER2-Positive Breast Cancer. Int J Mol Sci. 2016 Jul 1;17(7). pii: E1055. doi: 10.3390/ijms17071055. PubMed PMID: 27376283; PubMed Central PMCID: PMC4964431.

2: Gangwal RP, Damre MV, Das NR, Sharma SS, Sangamwar AT. Biological evaluation and structural insights for design of subtype-selective peroxisome proliferator activated receptor-α (PPAR-α) agonists. Bioorg Med Chem Lett. 2015 Jan 15;25(2):270-5. doi: 10.1016/j.bmcl.2014.11.052. Epub 2014 Nov 26. PubMed PMID: 25491112.