Synonym
YycG inhibitor 62; Yyc G inhibitor 62; Yyc-G inhibitor 62;
IUPAC/Chemical Name
4-(benzofuran-2-carbonyl)-1-(5-((2-chloro-4-methylbenzyl)thio)-1,3,4-thiadiazol-2-yl)-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
InChi Key
BIYNDOBOXIBFAA-UHFFFAOYSA-N
InChi Code
InChI=1S/C30H22ClN3O6S2/c1-15-7-8-18(19(31)11-15)14-41-30-33-32-29(42-30)34-25(17-9-10-20(35)22(13-17)39-2)24(27(37)28(34)38)26(36)23-12-16-5-3-4-6-21(16)40-23/h3-13,25,35,37H,14H2,1-2H3
SMILES Code
O=C1N(C2=NN=C(SCC3=CC=C(C)C=C3Cl)S2)C(C4=CC=C(O)C(OC)=C4)C(C(C5=CC6=CC=CC=C6O5)=O)=C1O
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
Preparing Stock Solutions
The following data is based on the
product
molecular weight
620.09
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.
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: Chen Z, Song K, Shang Y, Xiong Y, Lyu Z, Chen J, Zheng J, Li P, Wu Y, Gu C, Xie Y, Deng Q, Yu Z, Zhang J, Qu D. Selection and Identification of Novel Antibacterial Agents against Planktonic Growth and Biofilm Formation of Enterococcus faecalis. J Med Chem. 2021 Oct 28;64(20):15037-15052. doi: 10.1021/acs.jmedchem.1c00939. Epub 2021 Oct 16. PMID: 34657423.
2: Huang RZ, Zheng LK, Liu HY, Pan B, Hu J, Zhu T, Wang W, Jiang DB, Wu Y, Wu YC, Han SQ, Qu D. Thiazolidione derivatives targeting the histidine kinase YycG are effective against both planktonic and biofilm-associated Staphylococcus epidermidis. Acta Pharmacol Sin. 2012 Mar;33(3):418-25. doi: 10.1038/aps.2011.166. Epub 2012 Jan 9. Erratum in: Acta Pharmacol Sin. 2013 Nov;34(11):1484. PMID: 22231397; PMCID: PMC4077129.