E155-0097 Screening compound: N'-[2-(4-ethylpiperazin-1-yl)-2-(pyridin-3-yl)ethyl]-N-[(furan-2-yl)methyl]ethanediamide

E155-0097 Screening compound: N'-[2-(4-ethylpiperazin-1-yl)-2-(pyridin-3-yl)ethyl]-N-[(furan-2-yl)methyl]ethanediamide
E155-0097 Screening compound: N'-[2-(4-ethylpiperazin-1-yl)-2-(pyridin-3-yl)ethyl]-N-[(furan-2-yl)methyl]ethanediamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E155-0097
N'-[2-(4-ethylpiperazin-1-yl)-2-(pyridin-3-yl)ethyl]-N-[(furan-2-yl)methyl]ethanediamide

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

E155-0097

Molecular Formula

C20H27N5O3 (C20 H27 N5 O3)

Compound Name

N'-[2-(4-ethylpiperazin-1-yl)-2-(pyridin-3-yl)ethyl]-N-[(furan-2-yl)methyl]ethanediamide

IUPAC name

N'-[2-(4-ethylpiperazin-1-yl)-2-(pyridin-3-yl)ethyl]-N-[(furan-2-yl)methyl]ethanediamide

SMILES

CCN(CC1)CCN1C(CNC(C(NCc1ccco1)=O)=O)c1cnccc1

InChI

InChI=1S/C20H27N5O3/c1-2-24-8-10-25(11-9-24)18(16-5-3-7-21-13-16)15-23-20(27)19(26)22-14-17-6-4-12-28-17/h3-7,12-13,18H,2,8-11,14-15H2,1H3,(H,22,26)(H,23,27)/t18-/m0/s1

InChI Key

POPFLOYUOAZDOQ-SFHVURJKSA-N

MDL Number (MFCD)

MFCD05907531

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

385.47

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.310

Distribution Coefficient, logD

-0.158

Water Solubility, LogSw

-0.90

Polar Surface Area

73.129

Acid Dissociation Constant (pKa)

8.35

Base Dissociation Constant (pKb)

7.69

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.00

E155-0097 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

GPCR Targeted Library (31838 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
Targets:
  • GPCR
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with E155-0097 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E155-0097?
Check Price and Availability of E155-0097, 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 E155-0097 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E155-0097
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E155-0097
  • 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 E155-0097 available by request