E957-2247 Screening compound: N,N-diethyl-3-(2-phenoxypropanamido)-1-benzofuran-2-carboxamide

E957-2247 Screening compound: N,N-diethyl-3-(2-phenoxypropanamido)-1-benzofuran-2-carboxamide
E957-2247 Screening compound: N,N-diethyl-3-(2-phenoxypropanamido)-1-benzofuran-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E957-2247
N,N-diethyl-3-(2-phenoxypropanamido)-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

E957-2247

Molecular Formula

C22H24N2O4 (C22 H24 N2 O4)

Compound Name

N,N-diethyl-3-(2-phenoxypropanamido)-1-benzofuran-2-carboxamide

IUPAC name

NN-diethyl-3-(2-phenoxypropanamido)-1-benzofuran-2-carboxamide

SMILES

CCN(CC)C(c(oc1c2cccc1)c2NC(C(C)Oc1ccccc1)=O)=O

InChI

InChI=1S/C22H24N2O4/c1-4-24(5-2)22(26)20-19(17-13-9-10-14-18(17)28-20)23-21(25)15(3)27-16-11-7-6-8-12-16/h6-15H,4-5H2,1-3H3,(H,23,25)/t15-/m0/s1

InChI Key

KQBJQRIVUROPTB-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD14932381

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.44

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.662

Distribution Coefficient, logD

3.618

Water Solubility, LogSw

-3.82

Polar Surface Area

53.181

Acid Dissociation Constant (pKa)

8.38

Base Dissociation Constant (pKb)

0.21

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.30

E957-2247 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with E957-2247 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E957-2247?
Check Price and Availability of E957-2247, 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 E957-2247 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E957-2247
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E957-2247
  • 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 E957-2247 available by request