0584-0269 Screening compound: 2-(4-bromophenyl)-2-oxoethyl 2-phenoxyacetate

0584-0269 Screening compound: 2-(4-bromophenyl)-2-oxoethyl 2-phenoxyacetate
0584-0269 Screening compound: 2-(4-bromophenyl)-2-oxoethyl 2-phenoxyacetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0584-0269
2-(4-bromophenyl)-2-oxoethyl 2-phenoxyacetate

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

0584-0269

Molecular Formula

C16H13BrO4 (C16 H13 BrO4)

Compound Name

2-(4-bromophenyl)-2-oxoethyl 2-phenoxyacetate

IUPAC name

2-(4-bromophenyl)-2-oxoethyl 2-phenoxyacetate

SMILES

O=C(COC(COc1ccccc1)=O)c(cc1)ccc1Br

InChI

InChI=1S/C16H13BrO4/c17-13-8-6-12(7-9-13)15(18)10-21-16(19)11-20-14-4-2-1-3-5-14/h1-9H,10-11H2

InChI Key

ZWQQVIQRTFKJHI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00411847

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

349.18

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.393

Distribution Coefficient, logD

3.393

Water Solubility, LogSw

-3.51

Polar Surface Area

41.247

Acid Dissociation Constant (pKa)

23.46

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

0584-0269 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 0584-0269 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0584-0269?
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What is the minimum amount of 0584-0269 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0584-0269
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0584-0269
  • 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 0584-0269 available by request