2516-1974 Screening compound: 5-ethoxy-2-phenyl-1-benzofuran-3-carboxylic acid

2516-1974 Screening compound: 5-ethoxy-2-phenyl-1-benzofuran-3-carboxylic acid
2516-1974 Screening compound: 5-ethoxy-2-phenyl-1-benzofuran-3-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 2516-1974
5-ethoxy-2-phenyl-1-benzofuran-3-carboxylic acid

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

2516-1974

Molecular Formula

C17H14O4 (C17 H14 O4)

Compound Name

5-ethoxy-2-phenyl-1-benzofuran-3-carboxylic acid

IUPAC name

5-ethoxy-2-phenyl-1-benzofuran-3-carboxylic acid

SMILES

CCOc(cc1)cc2c1oc(-c1ccccc1)c2C(O)=O

InChI

InChI=1S/C17H14O4/c1-2-20-12-8-9-14-13(10-12)15(17(18)19)16(21-14)11-6-4-3-5-7-11/h3-10H,2H2,1H3,(H,18,19)

InChI Key

KVFWYSGPOFMEIA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01847520

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

282.3

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.313

Distribution Coefficient, logD

3.087

Water Solubility, LogSw

-4.29

Polar Surface Area

44.024

Acid Dissociation Constant (pKa)

6.20

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

2516-1974 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with 2516-1974 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2516-1974?
Check Price and Availability of 2516-1974, 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 2516-1974 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2516-1974
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2516-1974
  • 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 2516-1974 available by request