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MedKoo Cat#: 562212 | Name: Vitacoxib

Description:

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

Vitacoxib is a selective COX-2 inhibitor that is used as a novel nonsteroidal anti-inflammatory agent.

Chemical Structure

Vitacoxib
Vitacoxib
CAS#1374128-90-1

Theoretical Analysis

MedKoo Cat#: 562212

Name: Vitacoxib

CAS#: 1374128-90-1

Chemical Formula: C16H14ClN3O2S

Exact Mass: 347.0495

Molecular Weight: 347.81

Elemental Analysis: C, 55.25; H, 4.06; Cl, 10.19; N, 12.08; O, 9.20; S, 9.22

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
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Synonym
Vitacoxib;
IUPAC/Chemical Name
2-(4-Chloro-5-(p-tolyl)-1H-imidazol-1-yl)-5-(methylsulfonyl)pyridine
InChi Key
NSWKPXFHCORWAE-UHFFFAOYSA-N
InChi Code
InChI=1S/C16H14ClN3O2S/c1-11-3-5-12(6-4-11)15-16(17)19-10-20(15)14-8-7-13(9-18-14)23(2,21)22/h3-10H,1-2H3
SMILES Code
O=S(C1=CN=C(N2C(C3=CC=C(C)C=C3)=C(Cl)N=C2)C=C1)(C)=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
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 347.81 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
1: Wang J, Li Z, Sun F, Tang S, Zhang S, Lv P, Li J, Cao X. Evaluation of dermal irritation and skin sensitization due to vitacoxib. Toxicol Rep. 2017 Jun 10;4:287-290. doi: 10.1016/j.toxrep.2017.06.003. eCollection 2017. PubMed PMID: 28959651; PubMed Central PMCID: PMC5615138. 2: Wang J, Zhao T, Kong J, Peng H, Lv P, Li J, Cao X, Zhang S. Determination of vitacoxib, a novel COX-2 inhibitor, in equine plasma using UPLC-MS/MS detection: Development and validation of new methodology. J Chromatogr B Analyt Technol Biomed Life Sci. 2017 Sep 1;1061-1062:270-274. doi: 10.1016/j.jchromb.2017.07.024. Epub 2017 Jul 15. PubMed PMID: 28759842. 3: Wang J, Sun F, Tang S, Zhang S, Lv P, Li J, Cao X. Safety assessment of vitacoxib: Acute and 90-day sub-chronic oral toxicity studies. Regul Toxicol Pharmacol. 2017 Jun;86:49-58. doi: 10.1016/j.yrtph.2017.02.020. Epub 2017 Feb 24. PubMed PMID: 28238853.