MedKoo Cat#: 150015 | Name: DENV inhibitor 28a

Description:

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

DENV inhibitor 28a is a Pan-Serotype Dengue Virus NS4B Inhibitor. DENV inhibitor 28a has pan-serotype coverage (EC50's against the four DENV serotypes ranging from 0.0011 to 0.24 μM for 24a and from 0.00060 to 0.084 μM for 28a), chiral stability, and oral bioavailability in preclinical species. DENV inhibitor 28 also shows a dose-proportional increase in efficacy against DENV-2 infection in vivo in mice.

Chemical Structure

DENV inhibitor 28a
DENV inhibitor 28a
CAS#N/A

Theoretical Analysis

MedKoo Cat#: 150015

Name: DENV inhibitor 28a

CAS#: N/A

Chemical Formula: C28H29ClN2O6

Exact Mass: 524.1714

Molecular Weight: 525.00

Elemental Analysis: C, 64.06; H, 5.57; Cl, 6.75; N, 5.34; O, 18.28

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
DENV inhibitor 28a;
IUPAC/Chemical Name
2-(4-Chloro-2-methoxyphenyl)-2-((3-(2-hydroxyethoxy)-5-methoxyphenyl)amino)-1-(6-methoxy-5-methyl-1H-indol-3-yl)ethan-1-one
InChi Key
MDTUYCCZIYKBEI-UHFFFAOYSA-N
InChi Code
1S/C28H29ClN2O6/c1-16-9-22-23(15-30-24(22)14-25(16)35-3)28(33)27(21-6-5-17(29)10-26(21)36-4)31-18-11-19(34-2)13-20(12-18)37-8-7-32/h5-6,9-15,27,30-32H,7-8H2,1-4H3
SMILES Code
O=C(C1=CNC2=C1C=C(C)C(OC)=C2)C(C3=CC=C(Cl)C=C3OC)NC4=CC(OC)=CC(OCCO)=C4
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 525.00 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: Kesteleyn B, Bardiot D, Bonfanti JF, De Boeck B, Goethals O, Kaptein SJF, Stoops B, Coesemans E, Fortin J, Muller P, Doublet F, Carlens G, Koukni M, Smets W, Raboisson P, Chaltin P, Simmen K, Van Loock M, Neyts J, Marchand A, Jonckers THM. Discovery of Acyl-Indole Derivatives as Pan-Serotype Dengue Virus NS4B Inhibitors. J Med Chem. 2023 Jul 13;66(13):8808-8821. doi: 10.1021/acs.jmedchem.3c00403. Epub 2023 Jun 30. PMID: 37389813.