8005-2112 Screening compound: N-(2-acetyl-1-benzofuran-3-yl)acetamide

8005-2112 Screening compound: N-(2-acetyl-1-benzofuran-3-yl)acetamide
8005-2112 Screening compound: N-(2-acetyl-1-benzofuran-3-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8005-2112
N-(2-acetyl-1-benzofuran-3-yl)acetamide

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

8005-2112

Molecular Formula

C12H11NO3 (C12 H11 NO3)

Compound Name

N-(2-acetyl-1-benzofuran-3-yl)acetamide

IUPAC name

N-(2-acetyl-1-benzofuran-3-yl)acetamide

SMILES

CC(c(oc1c2cccc1)c2NC(C)=O)=O

InChI

InChI=1S/C12H11NO3/c1-7(14)12-11(13-8(2)15)9-5-3-4-6-10(9)16-12/h3-6H,1-2H3,(H,13,15)

InChI Key

KNEXUVWFSJOVDU-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00452696

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

217.22

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

0.955

Distribution Coefficient, logD

0.933

Water Solubility, LogSw

-1.93

Polar Surface Area

44.457

Acid Dissociation Constant (pKa)

8.69

Base Dissociation Constant (pKb)

-0.84

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

8005-2112 in Drug Discovery

Included in Screening Libraries

3CLpro Library (4801 compounds)

CORONAVIRUS Library (20774 compounds)

GABA Library (7115 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
  • Eye
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands
  • Epigenetic

References: we are preparing a list of scientific research reports with 8005-2112 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8005-2112?
Check Price and Availability of 8005-2112, 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 8005-2112 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8005-2112
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8005-2112
  • 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 8005-2112 available by request