MedKoo Cat#: 414210 | Name: KB 5246

Description:

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

KB 5246 is a tetracyclic quinolone and displays antibacterial activities.

Chemical Structure

KB 5246
KB 5246
CAS# 119474-55-4

Theoretical Analysis

MedKoo Cat#: 414210

Name: KB 5246

CAS#: 119474-55-4

Chemical Formula: C18H17ClFN3O4S

Exact Mass: 425.0612

Molecular Weight: 425.86

Elemental Analysis: C, 50.77; H, 4.02; Cl, 8.32; F, 4.46; N, 9.87; O, 15.03; S, 7.53

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 #
No Data
Synonym
KB 5246; KB-5246; KB5246
IUPAC/Chemical Name
3H,8H-4-Oxa-1-thia-9b-azacyclopenta(cd)phenalene-9-carboxylic acid, 6-fluoro-5-(4-methyl-1-piperazinyl)-8-oxo-, monohydrochloride
InChi Key
DCZBGPOFHPVYER-UHFFFAOYSA-N
InChi Code
InChI=1S/C18H16FN3O4S.ClH/c1-20-2-4-21(5-3-20)14-11(19)6-10-13-12-9(7-26-15(13)14)8-27-17(12)22(16(10)23)18(24)25;/h6,8H,2-5,7H2,1H3,(H,24,25);1H
SMILES Code
O=C(N(C1=O)C2=C3C(COC4=C3C1=CC(F)=C4N5CCN(C)CC5)=CS2)O.[H]Cl
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
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 425.86 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: Kotera Y, Mitsuhashi S. In vitro and in vivo antibacterial activities of KB-5246, a new tetracyclic quinolone. Antimicrob Agents Chemother. 1989 Nov;33(11):1896-900. doi: 10.1128/AAC.33.11.1896. PMID: 2610501; PMCID: PMC172784. 2: Kotera Y, Inoue M, Mitsuhashi S. Activity of KB-5246 against outer membrane mutants of Escherichia coli and Salmonella typhimurium. Antimicrob Agents Chemother. 1990 Jul;34(7):1323-5. doi: 10.1128/AAC.34.7.1323. PMID: 2167038; PMCID: PMC175974. 3: Kotera Y, Inoue Y, Ohashi M, Ito K, Inoue M. Lack of effect of carbonyl cyanide m-chlorophenylhydrazone on KB-5246 accumulation by Staphylococcus aureus. Antimicrob Agents Chemother. 1992 Apr;36(4):883-5. doi: 10.1128/AAC.36.4.883. PMID: 1323957; PMCID: PMC189480. 4: Nakanishi N, Kojima T, Fujimoto T, Mitsuhashi S. In vitro properties of the newer quinolones. Prog Drug Res. 1992;38:19-28. PMID: 1609115. 5: Chu DT, Lico IM, Claiborne AK, Plattner JJ, Pernet AG. Structure-activity relationship of quinolone antibacterial agents: the effects of C-2 substitution. Drugs Exp Clin Res. 1990;16(5):215-24. PMID: 1964116. 6: Kotera Y, Inoue Y, Ohashi M, Ito K, Tsukamoto G. Antibacterial activity of a new tetracyclic quinolone, No. 5290, against norfloxacin- and ciprofloxacin- resistant strains of Staphylococcus aureus. Chem Pharm Bull (Tokyo). 1991 Oct;39(10):2644-6. doi: 10.1248/cpb.39.2644. PMID: 1666861.