E228-2542 Screening compound: N-[(4-ethoxyphenyl)methyl]-3-{7-fluoro-4-oxo-4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl}propanamide

E228-2542 Screening compound: N-[(4-ethoxyphenyl)methyl]-3-{7-fluoro-4-oxo-4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl}propanamide
E228-2542 Screening compound: N-[(4-ethoxyphenyl)methyl]-3-{7-fluoro-4-oxo-4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl}propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E228-2542
N-[(4-ethoxyphenyl)methyl]-3-{7-fluoro-4-oxo-4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl}propanamide

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

E228-2542

Molecular Formula

C23H22FN3O3 (C23 H22 FN3 O3)

Compound Name

N-[(4-ethoxyphenyl)methyl]-3-{7-fluoro-4-oxo-4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl}propanamide

IUPAC name

N-[(4-ethoxyphenyl)methyl]-3-{7-fluoro-4-oxo-4H5H-pyrrolo[12-a]quinoxalin-5-yl}propanamide

SMILES

CCOc1ccc(CNC(CCN(c(cc(cc2)F)c2-n2c3ccc2)C3=O)=O)cc1

InChI

InChI=1S/C23H22FN3O3/c1-2-30-18-8-5-16(6-9-18)15-25-22(28)11-13-27-21-14-17(24)7-10-19(21)26-12-3-4-20(26)23(27)29/h3-10,12,14H,2,11,13,15H2,1H3,(H,25,28)

InChI Key

RHSFDDNOMUBSOK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14850100

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.599

Distribution Coefficient, logD

3.599

Water Solubility, LogSw

-3.77

Polar Surface Area

48.539

Acid Dissociation Constant (pKa)

13.41

Base Dissociation Constant (pKb)

-2.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

E228-2542 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antiviral Annotated Library (21441 compounds)

Human Proteases Annotated Library (2868 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with E228-2542 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E228-2542?
Check Price and Availability of E228-2542, 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 E228-2542 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E228-2542
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E228-2542
  • 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 E228-2542 available by request