8008-8455 Screening compound: N'-(4-ethylphenyl)-N-{2-[4-(4-methoxybenzoyl)piperazin-1-yl]ethyl}ethanediamide

8008-8455 Screening compound: N'-(4-ethylphenyl)-N-{2-[4-(4-methoxybenzoyl)piperazin-1-yl]ethyl}ethanediamide
8008-8455 Screening compound: N'-(4-ethylphenyl)-N-{2-[4-(4-methoxybenzoyl)piperazin-1-yl]ethyl}ethanediamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-8455
N'-(4-ethylphenyl)-N-{2-[4-(4-methoxybenzoyl)piperazin-1-yl]ethyl}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

8008-8455

Molecular Formula

C24H30N4O4 (C24 H30 N4 O4)

Compound Name

N'-(4-ethylphenyl)-N-{2-[4-(4-methoxybenzoyl)piperazin-1-yl]ethyl}ethanediamide

IUPAC name

N'-(4-ethylphenyl)-N-{2-[4-(4-methoxybenzoyl)piperazin-1-yl]ethyl}ethanediamide

SMILES

CCc(cc1)ccc1NC(C(NCCN(CC1)CCN1C(c(cc1)ccc1OC)=O)=O)=O

InChI

InChI=1S/C24H30N4O4/c1-3-18-4-8-20(9-5-18)26-23(30)22(29)25-12-13-27-14-16-28(17-15-27)24(31)19-6-10-21(32-2)11-7-19/h4-11H,3,12-17H2,1-2H3,(H,25,29)(H,26,30)

InChI Key

OUXIYIFKBSNJRQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01460166

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.53

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.057

Distribution Coefficient, logD

1.931

Water Solubility, LogSw

-2.74

Polar Surface Area

75.838

Acid Dissociation Constant (pKa)

7.90

Base Dissociation Constant (pKb)

5.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

8008-8455 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Dark Chemical Matter Library (18430 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
Targets:
  • Proteases
  • Ion Channels

References: we are preparing a list of scientific research reports with 8008-8455 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-8455?
Check Price and Availability of 8008-8455, 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 8008-8455 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-8455
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-8455
  • 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 8008-8455 available by request