0781-2381 Screening compound: 4-formylphenyl furan-2-carboxylate

0781-2381 Screening compound: 4-formylphenyl furan-2-carboxylate
0781-2381 Screening compound: 4-formylphenyl furan-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0781-2381
4-formylphenyl furan-2-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

0781-2381

Molecular Formula

C12H8O4 (C12 H8 O4)

Compound Name

4-formylphenyl furan-2-carboxylate

IUPAC name

4-formylphenyl furan-2-carboxylate

SMILES

O=Cc(cc1)ccc1OC(c1ccco1)=O

InChI

InChI=1S/C12H8O4/c13-8-9-3-5-10(6-4-9)16-12(14)11-2-1-7-15-11/h1-8H

InChI Key

ALUHEYPQVPMFBV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00453913

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

216.19

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.853

Distribution Coefficient, logD

1.853

Water Solubility, LogSw

-1.74

Polar Surface Area

43.354

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0781-2381 in Drug Discovery

Included in Screening Libraries

Frequent Hitters Library (7624 compounds)

Covalent Inhibitors Library (7986 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Included in 1.7M Stock Database

Structure:
  • Pool
  • Cyclic compounds
  • 3D
  • Fragments

References: we are preparing a list of scientific research reports with 0781-2381 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0781-2381?
Check Price and Availability of 0781-2381, 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 0781-2381 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0781-2381
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0781-2381
  • 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 0781-2381 available by request