E957-2348 Screening compound: 2,6-difluoro-N-[2-(pyrrolidine-1-carbonyl)-1-benzofuran-3-yl]benzamide

E957-2348 Screening compound: 2,6-difluoro-N-[2-(pyrrolidine-1-carbonyl)-1-benzofuran-3-yl]benzamide
E957-2348 Screening compound: 2,6-difluoro-N-[2-(pyrrolidine-1-carbonyl)-1-benzofuran-3-yl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E957-2348
2,6-difluoro-N-[2-(pyrrolidine-1-carbonyl)-1-benzofuran-3-yl]benzamide

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

E957-2348

Molecular Formula

C20H16F2N2O3 (C20 H16 F2 N2 O3)

Compound Name

2,6-difluoro-N-[2-(pyrrolidine-1-carbonyl)-1-benzofuran-3-yl]benzamide

IUPAC name

26-difluoro-N-[2-(pyrrolidine-1-carbonyl)-1-benzofuran-3-yl]benzamide

SMILES

O=C(c(oc1c2cccc1)c2NC(c(c(F)ccc1)c1F)=O)N1CCCC1

InChI

InChI=1S/C20H16F2N2O3/c21-13-7-5-8-14(22)16(13)19(25)23-17-12-6-1-2-9-15(12)27-18(17)20(26)24-10-3-4-11-24/h1-2,5-9H,3-4,10-11H2,(H,23,25)

InChI Key

JORWILIXNRTSIY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14932440

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

370.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.500

Distribution Coefficient, logD

1.394

Water Solubility, LogSw

-3.88

Polar Surface Area

47.474

Acid Dissociation Constant (pKa)

5.30

Base Dissociation Constant (pKb)

-1.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

E957-2348 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Agro:
  • Agro

References: we are preparing a list of scientific research reports with E957-2348 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E957-2348?
Check Price and Availability of E957-2348, 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 E957-2348 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E957-2348
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E957-2348
  • 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 E957-2348 available by request