4534-2724 Screening compound: 2-(4-bromo-3-methylphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide

4534-2724 Screening compound: 2-(4-bromo-3-methylphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide
4534-2724 Screening compound: 2-(4-bromo-3-methylphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4534-2724
2-(4-bromo-3-methylphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

4534-2724

Molecular Formula

C17H18BrNO3 (C17 H18 BrNO3)

Compound Name

2-(4-bromo-3-methylphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide

IUPAC name

2-(4-bromo-3-methylphenoxy)-N-[(4-methoxyphenyl)methyl]acetamide

SMILES

Cc(cc(cc1)OCC(NCc(cc2)ccc2OC)=O)c1Br

InChI

InChI=1S/C17H18BrNO3/c1-12-9-15(7-8-16(12)18)22-11-17(20)19-10-13-3-5-14(21-2)6-4-13/h3-9H,10-11H2,1-2H3,(H,19,20)

InChI Key

QDKZPISAWPVKRB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02012078

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.24

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.785

Distribution Coefficient, logD

3.785

Water Solubility, LogSw

-4.06

Polar Surface Area

39.481

Acid Dissociation Constant (pKa)

14.16

Base Dissociation Constant (pKb)

-2.10

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

4534-2724 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4534-2724 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4534-2724?
Check Price and Availability of 4534-2724, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of 4534-2724 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4534-2724
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4534-2724
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 4534-2724 available by request