8006-3343 Screening compound: 2-(4-bromophenyl)-2-oxoethyl 4-benzylbenzoate

8006-3343 Screening compound: 2-(4-bromophenyl)-2-oxoethyl 4-benzylbenzoate
8006-3343 Screening compound: 2-(4-bromophenyl)-2-oxoethyl 4-benzylbenzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8006-3343
2-(4-bromophenyl)-2-oxoethyl 4-benzylbenzoate

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

8006-3343

Molecular Formula

C22H17BrO3 (C22 H17 BrO3)

Compound Name

2-(4-bromophenyl)-2-oxoethyl 4-benzylbenzoate

IUPAC name

2-(4-bromophenyl)-2-oxoethyl 4-benzylbenzoate

SMILES

O=C(COC(c1ccc(Cc2ccccc2)cc1)=O)c(cc1)ccc1Br

InChI

InChI=1S/C22H17BrO3/c23-20-12-10-18(11-13-20)21(24)15-26-22(25)19-8-6-17(7-9-19)14-16-4-2-1-3-5-16/h1-13H,14-15H2

InChI Key

UBLDXPQXSBQMIL-UHFFFAOYSA-N

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.28

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.785

Distribution Coefficient, logD

5.785

Water Solubility, LogSw

-6.13

Polar Surface Area

34.071

Acid Dissociation Constant (pKa)

22.46

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

9.10

References: we are preparing a list of scientific research reports with 8006-3343 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8006-3343?
Check Price and Availability of 8006-3343, 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 8006-3343 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8006-3343
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8006-3343
  • 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 8006-3343 available by request