E957-0784 Screening compound: N-{2-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-1-benzofuran-3-yl}cyclohexanecarboxamide

E957-0784 Screening compound: N-{2-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-1-benzofuran-3-yl}cyclohexanecarboxamide
E957-0784 Screening compound: N-{2-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-1-benzofuran-3-yl}cyclohexanecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E957-0784
N-{2-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-1-benzofuran-3-yl}cyclohexanecarboxamide

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

E957-0784

Molecular Formula

C25H27N3O5 (C25 H27 N3 O5)

Compound Name

N-{2-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-1-benzofuran-3-yl}cyclohexanecarboxamide

IUPAC name

N-{2-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-1-benzofuran-3-yl}cyclohexanecarboxamide

SMILES

O=C(C1CCCCC1)Nc1c(C(N(CC2)CCN2C(c2ccco2)=O)=O)oc2c1cccc2

InChI

InChI=1S/C25H27N3O5/c29-23(17-7-2-1-3-8-17)26-21-18-9-4-5-10-19(18)33-22(21)25(31)28-14-12-27(13-15-28)24(30)20-11-6-16-32-20/h4-6,9-11,16-17H,1-3,7-8,12-15H2,(H,26,29)

InChI Key

VNCLAUGRLSCQRI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14932061

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

449.51

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.132

Distribution Coefficient, logD

3.043

Water Solubility, LogSw

-3.05

Polar Surface Area

72.335

Acid Dissociation Constant (pKa)

8.04

Base Dissociation Constant (pKb)

-0.51

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

E957-0784 in Drug Discovery

Included in Screening Libraries

GABA Library (7115 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E957-0784 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E957-0784?
Check Price and Availability of E957-0784, 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 E957-0784 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E957-0784
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E957-0784
  • 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 E957-0784 available by request