BRD4 inhibitor 9a | CAS# 2761321-18-8 | BRD4 Inhibitor

MedKoo Cat#: 130575 | Name: BRD4 inhibitor 9a

Description:

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

BRD4 inhibitor 9a is a BRD4 inhibitor with an IC50 of 38.20 μM.

Chemical Structure

BRD4 inhibitor 9a

CAS#2761321-18-8

Theoretical Analysis

MedKoo Cat#: 130575

Name: BRD4 inhibitor 9a

CAS#: 2761321-18-8

Chemical Formula: C16H15BrN4O4

Exact Mass: 406.0277

Molecular Weight: 407.22

Elemental Analysis: C, 47.19; H, 3.71; Br, 19.62; N, 13.76; O, 15.72

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

BRD4-inhibitor-9a, BRD4 In 9a, BRD4-In-9a, BRD4-BD1-IN-1 (Compound 9a)

IUPAC/Chemical Name

(7-(3-Bromobenzyl)-3-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)methyl acetate

InChi Key

OEDSSFKMVLBERJ-UHFFFAOYSA-N

InChi Code

InChI=1S/C16H15BrN4O4/c1-9(22)25-8-12-18-14-13(15(23)19-16(24)20(14)2)21(12)7-10-4-3-5-11(17)6-10/h3-6H,7-8H2,1-2H3,(H,19,23,24)

SMILES Code

CC(OCC(N1CC2=CC=CC(Br)=C2)=NC(N(C)C(N3)=O)=C1C3=O)=O

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

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 407.22 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. Fan Y, Luo F, Su M, Li Q, Zhong T, Xiong L, Li M, Yuan M, Wang D. Structure optimization, synthesis, and biological evaluation of 6-(2-amino-1H-benzo[d]imidazole-6-yl)-quinazolin-4(3H)-one derivatives as potential multi-targeted anticancer agents via Aurora A/ PI3K/BRD4 inhibition. Bioorg Chem. 2023 Mar;132:106352. doi: 10.1016/j.bioorg.2023.106352. Epub 2023 Jan 18. PMID: 36682147.