5274-1240 Screening compound: 2-(4-bromophenyl)-2-oxoethyl 9H-xanthene-9-carboxylate

5274-1240 Screening compound: 2-(4-bromophenyl)-2-oxoethyl 9H-xanthene-9-carboxylate
5274-1240 Screening compound: 2-(4-bromophenyl)-2-oxoethyl 9H-xanthene-9-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 5274-1240
2-(4-bromophenyl)-2-oxoethyl 9H-xanthene-9-carboxylate

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

5274-1240

Molecular Formula

C22H15BrO4 (C22 H15 BrO4)

Compound Name

2-(4-bromophenyl)-2-oxoethyl 9H-xanthene-9-carboxylate

IUPAC name

2-(4-bromophenyl)-2-oxoethyl 9H-xanthene-9-carboxylate

SMILES

O=C(COC(C1c(cccc2)c2Oc2c1cccc2)=O)c(cc1)ccc1Br

InChI

InChI=1S/C22H15BrO4/c23-15-11-9-14(10-12-15)18(24)13-26-22(25)21-16-5-1-3-7-19(16)27-20-8-4-2-6-17(20)21/h1-12,21H,13H2

InChI Key

QWNOZIWDWPIZLJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01138553

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

423.26

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.946

Distribution Coefficient, logD

-1.529

Water Solubility, LogSw

-5.17

Polar Surface Area

41.157

Acid Dissociation Constant (pKa)

0.92

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 5274-1240 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5274-1240?
Check Price and Availability of 5274-1240, 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 5274-1240 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5274-1240
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5274-1240
  • 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 5274-1240 available by request