MedKoo Cat#: 535174 | Name: MMH409

Description:

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

MMH409 is a novel potent and selective HDAC8 inhibitor. MMH409 exhibits potent in vitro HDAC8 activity (IC50 = 66 nM) and up to 410-fold selectivity for HDAC8 over the next targeted HDAC. Experimental and computational analyses of the benzanilide structure docked with human HDAC8 enzyme showed the adoption of a low-energy L-shaped conformer that favors HDAC8 selectivity. The conformationally constrained HDAC8 inhibitors present an alternative biological probe for further determining the clinical utility and safety of pharmacological knockdown of HDAC8 in diseased cells.

Chemical Structure

MMH409
CAS#2704554-86-7

Theoretical Analysis

MedKoo Cat#: 535174

Name: MMH409

CAS#: 2704554-86-7

Chemical Formula: C19H16F6N2O3

Exact Mass: 434.1065

Molecular Weight: 434.34

Elemental Analysis: C, 52.54; H, 3.71; F, 26.24; N, 6.45; O, 11.05

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
MMH409; MMH-409; MMH 409
IUPAC/Chemical Name
N-(4-(Hydroxycarbamoyl)phenyl)-N-isopropyl-3,5-bis(trifluoromethyl)benzamide
InChi Key
JVCQXJCACOCTST-UHFFFAOYSA-N
InChi Code
InChI=1S/C19H16F6N2O3/c1-10(2)27(15-5-3-11(4-6-15)16(28)26-30)17(29)12-7-13(18(20,21)22)9-14(8-12)19(23,24)25/h3-10,30H,1-2H3,(H,26,28)
SMILES Code
O=C(N(C1=CC=C(C(NO)=O)C=C1)C(C)C)C2=CC(C(F)(F)F)=CC(C(F)(F)F)=C2
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
>3 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 434.34 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: Hassan MM, Israelian J, Nawar N, Ganda G, Manaswiyoungkul P, Raouf Y, Armstrong D, Sedighi A, Olaoye OO, Erdogan F, Cabral AD, Angeles F, Altintas R, de Araujo ED, Gunning PT. Characterization of Conformationally Constrained Benzanilide Scaffolds for Potent and Selective HDAC8 Targeting. J Med Chem. 2020 Jul 16. doi: 10.1021/acs.jmedchem.0c01025. Epub ahead of print. PMID: 32672458.