E957-2136 Screening compound: N-[2-(dimethylamino)ethyl]-N-[(furan-2-yl)methyl]-3-(2-phenoxyacetamido)-1-benzofuran-2-carboxamide

E957-2136 Screening compound: N-[2-(dimethylamino)ethyl]-N-[(furan-2-yl)methyl]-3-(2-phenoxyacetamido)-1-benzofuran-2-carboxamide
E957-2136 Screening compound: N-[2-(dimethylamino)ethyl]-N-[(furan-2-yl)methyl]-3-(2-phenoxyacetamido)-1-benzofuran-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E957-2136
N-[2-(dimethylamino)ethyl]-N-[(furan-2-yl)methyl]-3-(2-phenoxyacetamido)-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

E957-2136

Molecular Formula

C26H27N3O5 (C26 H27 N3 O5)

Compound Name

N-[2-(dimethylamino)ethyl]-N-[(furan-2-yl)methyl]-3-(2-phenoxyacetamido)-1-benzofuran-2-carboxamide

IUPAC name

N-[2-(dimethylamino)ethyl]-N-[(furan-2-yl)methyl]-3-(2-phenoxyacetamido)-1-benzofuran-2-carboxamide

SMILES

CN(C)CCN(Cc1ccco1)C(c(oc1c2cccc1)c2NC(COc1ccccc1)=O)=O

InChI

InChI=1S/C26H27N3O5/c1-28(2)14-15-29(17-20-11-8-16-32-20)26(31)25-24(21-12-6-7-13-22(21)34-25)27-23(30)18-33-19-9-4-3-5-10-19/h3-13,16H,14-15,17-18H2,1-2H3,(H,27,30)

InChI Key

VQGWQQYSVVGMPB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14932364

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

461.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.669

Distribution Coefficient, logD

2.882

Water Solubility, LogSw

-3.81

Polar Surface Area

65.550

Acid Dissociation Constant (pKa)

8.89

Base Dissociation Constant (pKb)

8.11

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.10

E957-2136 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Nervous system
Targets:
  • Others
  • Ion Channels
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with E957-2136 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E957-2136?
Check Price and Availability of E957-2136, 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 E957-2136 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E957-2136
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E957-2136
  • 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 E957-2136 available by request