4989-0020 Screening compound: (3Z)-3-[(4-bromophenyl)methylidene]-5-(4-fluorophenyl)-2,3-dihydrofuran-2-one

4989-0020 Screening compound: (3Z)-3-[(4-bromophenyl)methylidene]-5-(4-fluorophenyl)-2,3-dihydrofuran-2-one
4989-0020 Screening compound: (3Z)-3-[(4-bromophenyl)methylidene]-5-(4-fluorophenyl)-2,3-dihydrofuran-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 4989-0020
(3Z)-3-[(4-bromophenyl)methylidene]-5-(4-fluorophenyl)-2,3-dihydrofuran-2-one

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

4989-0020

Molecular Formula

C17H10BrFO2 (C17 H10 BrFO2)

Compound Name

(3Z)-3-[(4-bromophenyl)methylidene]-5-(4-fluorophenyl)-2,3-dihydrofuran-2-one

IUPAC name

(3Z)-3-[(4-bromophenyl)methylidene]-5-(4-fluorophenyl)-23-dihydrofuran-2-one

SMILES

O=C1OC(c(cc2)ccc2F)=C/C1=C/c(cc1)ccc1Br

InChI

InChI=1S/C17H10BrFO2/c18-14-5-1-11(2-6-14)9-13-10-16(21-17(13)20)12-3-7-15(19)8-4-12/h1-10H

InChI Key

CBFDWMNLQPPCNJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04597247

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

345.17

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.022

Distribution Coefficient, logD

5.022

Water Solubility, LogSw

-5.14

Polar Surface Area

22.740

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with 4989-0020 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4989-0020?
Check Price and Availability of 4989-0020, 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 4989-0020 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4989-0020
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4989-0020
  • 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 4989-0020 available by request