C686-0581 Screening compound: N-(2-fluorophenyl)-3-[2-(2-methoxyphenoxy)acetamido]-1-benzofuran-2-carboxamide

C686-0581 Screening compound: N-(2-fluorophenyl)-3-[2-(2-methoxyphenoxy)acetamido]-1-benzofuran-2-carboxamide
C686-0581 Screening compound: N-(2-fluorophenyl)-3-[2-(2-methoxyphenoxy)acetamido]-1-benzofuran-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C686-0581
N-(2-fluorophenyl)-3-[2-(2-methoxyphenoxy)acetamido]-1-benzofuran-2-carboxamide

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

C686-0581

Molecular Formula

C24H19FN2O5 (C24 H19 FN2 O5)

Compound Name

N-(2-fluorophenyl)-3-[2-(2-methoxyphenoxy)acetamido]-1-benzofuran-2-carboxamide

IUPAC name

N-(2-fluorophenyl)-3-[2-(2-methoxyphenoxy)acetamido]-1-benzofuran-2-carboxamide

SMILES

COc(cccc1)c1OCC(Nc1c(C(Nc(cccc2)c2F)=O)oc2c1cccc2)=O

InChI

InChI=1S/C24H19FN2O5/c1-30-19-12-6-7-13-20(19)31-14-21(28)27-22-15-8-2-5-11-18(15)32-23(22)24(29)26-17-10-4-3-9-16(17)25/h2-13H,14H2,1H3,(H,26,29)(H,27,28)

InChI Key

JYWLJASGTCEPDT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05713728

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.130

Distribution Coefficient, logD

4.129

Water Solubility, LogSw

-4.39

Polar Surface Area

67.856

Acid Dissociation Constant (pKa)

9.57

Base Dissociation Constant (pKb)

-1.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

C686-0581 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Adenosine Receptors Targeted Library (19896 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Eye
  • Cardiovascular
Targets:
  • Others
  • GPCR
Mechanism of action:
  • Epigenetic
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C686-0581 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C686-0581?
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What is the minimum amount of C686-0581 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C686-0581
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C686-0581
  • 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 C686-0581 available by request