E524-0002 Screening compound: 5-{2-[4-(4-chlorophenyl)piperazino]-2-oxoethyl}pyrido[2,3-e]pyrrolo[1,2-a]pyrazin-6(5H)-one

E524-0002 Screening compound: 5-{2-[4-(4-chlorophenyl)piperazino]-2-oxoethyl}pyrido[2,3-e]pyrrolo[1,2-a]pyrazin-6(5H)-one
E524-0002 Screening compound: 5-{2-[4-(4-chlorophenyl)piperazino]-2-oxoethyl}pyrido[2,3-e]pyrrolo[1,2-a]pyrazin-6(5H)-one alternative view

Chemical Structure Depiction of ChemDiv screening compound E524-0002
5-{2-[4-(4-chlorophenyl)piperazino]-2-oxoethyl}pyrido[2,3-e]pyrrolo[1,2-a]pyrazin-6(5H)-one

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

E524-0002

Molecular Formula

C22H20ClN5O2 (C22 H20 ClN5 O2)

Compound Name

5-{2-[4-(4-chlorophenyl)piperazino]-2-oxoethyl}pyrido[2,3-e]pyrrolo[1,2-a]pyrazin-6(5H)-one

IUPAC name

8-{2-[4-(4-chlorophenyl)piperazin-1-yl]-2-oxoethyl}-2810-triazatricyclo[7.4.0.0^{26}]trideca-1(13)35911-pentaen-7-one

SMILES

O=C(CN(C1=O)c2ncccc2-n2c1ccc2)N(CC1)CCN1c(cc1)ccc1Cl

InChI

InChI=1S/C22H20ClN5O2/c23-16-5-7-17(8-6-16)25-11-13-26(14-12-25)20(29)15-28-21-18(3-1-9-24-21)27-10-2-4-19(27)22(28)30/h1-10H,11-15H2

InChI Key

KVNKRESZDZVNBD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14894689

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

421.89

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.007

Distribution Coefficient, logD

3.007

Water Solubility, LogSw

-3.33

Polar Surface Area

46.949

Acid Dissociation Constant (pKa)

19.01

Base Dissociation Constant (pKb)

5.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

E524-0002 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Library (67538 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
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with E524-0002 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E524-0002?
Check Price and Availability of E524-0002, 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 E524-0002 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E524-0002
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E524-0002
  • 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 E524-0002 available by request