MedKoo Cat#: 562963 | Name: CAY10589
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Description:

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

CAY10589 is an inhibitor of mPGES-1.

Chemical Structure

CAY10589
CAY10589
CAS#1077626-52-8

Theoretical Analysis

MedKoo Cat#: 562963

Name: CAY10589

CAS#: 1077626-52-8

Chemical Formula: C25H28ClN3O2S

Exact Mass: 469.1591

Molecular Weight: 470.02

Elemental Analysis: C, 63.88; H, 6.00; Cl, 7.54; N, 8.94; O, 6.81; S, 6.82

Price and Availability

Size Price Availability Quantity
5mg USD 485.00 2 Weeks
10mg USD 900.00 2 Weeks
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Related CAS #
No Data
Synonym
CAY10589; CAY-10589; CAY 10589;
IUPAC/Chemical Name
2-[[4-[([1,1′-Biphenyl]-4-ylmethyl)amino]-6-chloro-2-pyrimidinyl]thio]-octanoic acid
InChi Key
FQMPYBCEABTPIK-UHFFFAOYSA-N
InChi Code
InChI=1S/C25H28ClN3O2S/c1-2-3-4-8-11-21(24(30)31)32-25-28-22(26)16-23(29-25)27-17-18-12-14-20(15-13-18)19-9-6-5-7-10-19/h5-7,9-10,12-16,21H,2-4,8,11,17H2,1H3,(H,30,31)(H,27,28,29)
SMILES Code
CCCCCCC(SC1=NC(Cl)=CC(NCC2=CC=C(C3=CC=CC=C3)C=C2)=N1)C(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
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 470.02 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: Wiegard A, Hanekamp W, Griessbach K, Fabian J, Lehr M. Pyrrole alkanoic acid derivatives as nuisance inhibitors of microsomal prostaglandin E2 synthase-1. Eur J Med Chem. 2012 Feb;48:153-63. doi: 10.1016/j.ejmech.2011.12.009. Epub 2011 Dec 9. PubMed PMID: 22209272.