E002-2295 Screening compound: N-[2-(4-benzylpiperazine-1-carbonyl)-1-benzofuran-3-yl]-3-chlorobenzamide

E002-2295 Screening compound: N-[2-(4-benzylpiperazine-1-carbonyl)-1-benzofuran-3-yl]-3-chlorobenzamide
E002-2295 Screening compound: N-[2-(4-benzylpiperazine-1-carbonyl)-1-benzofuran-3-yl]-3-chlorobenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E002-2295
N-[2-(4-benzylpiperazine-1-carbonyl)-1-benzofuran-3-yl]-3-chlorobenzamide

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

E002-2295

Molecular Formula

C27H24ClN3O3 (C27 H24 ClN3 O3)

Compound Name

N-[2-(4-benzylpiperazine-1-carbonyl)-1-benzofuran-3-yl]-3-chlorobenzamide

IUPAC name

N-[2-(4-benzylpiperazine-1-carbonyl)-1-benzofuran-3-yl]-3-chlorobenzamide

SMILES

O=C(c(oc1c2cccc1)c2NC(c1cccc(Cl)c1)=O)N1CCN(Cc2ccccc2)CC1

InChI

InChI=1S/C27H24ClN3O3/c28-21-10-6-9-20(17-21)26(32)29-24-22-11-4-5-12-23(22)34-25(24)27(33)31-15-13-30(14-16-31)18-19-7-2-1-3-8-19/h1-12,17H,13-16,18H2,(H,29,32)

InChI Key

YOONSNYUASMMEV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14835707

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

473.96

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.472

Distribution Coefficient, logD

3.318

Water Solubility, LogSw

-4.63

Polar Surface Area

50.649

Acid Dissociation Constant (pKa)

6.28

Base Dissociation Constant (pKb)

5.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.50

E002-2295 in Drug Discovery

Included in Screening Libraries

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with E002-2295 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E002-2295?
Check Price and Availability of E002-2295, 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 E002-2295 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E002-2295
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E002-2295
  • 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 E002-2295 available by request