4724-2775 Screening compound: 4-{[(3E)-5-(4-bromophenyl)-2-oxo-2,3-dihydrofuran-3-ylidene]methyl}-2-methoxyphenyl acetate

4724-2775 Screening compound: 4-{[(3E)-5-(4-bromophenyl)-2-oxo-2,3-dihydrofuran-3-ylidene]methyl}-2-methoxyphenyl acetate
4724-2775 Screening compound: 4-{[(3E)-5-(4-bromophenyl)-2-oxo-2,3-dihydrofuran-3-ylidene]methyl}-2-methoxyphenyl acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 4724-2775
4-{[(3E)-5-(4-bromophenyl)-2-oxo-2,3-dihydrofuran-3-ylidene]methyl}-2-methoxyphenyl acetate

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

4724-2775

Molecular Formula

C20H15BrO5 (C20 H15 BrO5)

Compound Name

4-{[(3E)-5-(4-bromophenyl)-2-oxo-2,3-dihydrofuran-3-ylidene]methyl}-2-methoxyphenyl acetate

IUPAC name

4-{[(3E)-5-(4-bromophenyl)-2-oxo-23-dihydrofuran-3-ylidene]methyl}-2-methoxyphenyl acetate

SMILES

CC(Oc(ccc(/C=C(\C=C(c(cc1)ccc1Br)O1)/C1=O)c1)c1OC)=O

InChI

InChI=1S/C20H15BrO5/c1-12(22)25-17-8-3-13(10-19(17)24-2)9-15-11-18(26-20(15)23)14-4-6-16(21)7-5-14/h3-11H,1-2H3

InChI Key

WLQGXZJBSNGJOQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02107539

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

415.24

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.505

Distribution Coefficient, logD

4.505

Water Solubility, LogSw

-4.59

Polar Surface Area

51.208

Acid Dissociation Constant (pKa)

22.67

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

References: we are preparing a list of scientific research reports with 4724-2775 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4724-2775?
Check Price and Availability of 4724-2775, 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 4724-2775 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4724-2775
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4724-2775
  • 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 4724-2775 available by request