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MedKoo Cat#: 145423 | Name: CP-199331

Description:

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

CP-199331 is a cysLT1 receptor antagonist. CP-199331is equipotent to marketed cysLT1 receptor antagonists zafirlukast and pranlukast, and shows good pharmacokinetics in rats and monkeys, and are devoid of liver toxicity in monkeys as seen in CP-85,958.

Chemical Structure

CP-199331
CP-199331
CAS#158102-93-3

Theoretical Analysis

MedKoo Cat#: 145423

Name: CP-199331

CAS#: 158102-93-3

Chemical Formula: C26H21F5N2O6S2

Exact Mass: 616.0761

Molecular Weight: 616.57

Elemental Analysis: C, 50.65; H, 3.43; F, 15.41; N, 4.54; O, 15.57; S, 10.40

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.
Bulk Inquiry
Related CAS #
No Data
Synonym
CP-199331; CP199331; CP 199331; CP-199,331;
IUPAC/Chemical Name
N-(3-(((3R,4R)-6-((5,6-difluorobenzo[d]thiazol-2-yl)methoxy)-4-hydroxychroman-3-yl)methyl)-4-methoxyphenyl)-1,1,1-trifluoromethanesulfonamide
InChi Key
OFYJBLBCZNRWLC-DLUDVSRJSA-N
InChi Code
1S/C26H21F5N2O6S2/c1-37-21-4-2-15(33-41(35,36)26(29,30)31)7-13(21)6-14-11-39-22-5-3-16(8-17(22)25(14)34)38-12-24-32-20-9-18(27)19(28)10-23(20)40-24/h2-5,7-10,14,25,33-34H,6,11-12H2,1H3/t14-,25-/m1/s1
SMILES Code
COC1=C(C[C@@H]2COC3=C(C=C(OCC4=NC5=CC(F)=C(F)C=C5S4)C=C3)[C@@H]2O)C=C(NS(=O)(=O)C(F)(F)F)C=C1
Appearance
To be determined
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
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
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 616.57 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: Chambers RJ, Marfat A, Antognoli GW, Cheng JB, Damon DB, Kuperman AV, Liston TC, Mebus C, Pillar JS, Shirley JT, Watson JW. Discovery of CP-199,330 and CP-199,331: two potent and orally efficacious cysteinyl LT1 receptor antagonists devoid of liver toxicity. Bioorg Med Chem Lett. 1999 Sep 20;9(18):2773-8. doi: 10.1016/s0960-894x(99)00461-8. PMID: 10509933. 2: Kuperman AV, Kalgutkar AS, Marfat A, Chambers RJ, Liston TE. Pharmacokinetics and metabolism of a cysteinyl leukotriene-1 receptor antagonist from the heterocyclic chromanol series in rats: in vitro-in vivo correlation, gender- related differences, isoform identification, and comparison with metabolism in human hepatic tissue. Drug Metab Dispos. 2001 Nov;29(11):1403-9. PMID: 11602515.