E228-2811 Screening compound: N-[2-(3,4-diethoxyphenyl)ethyl]-4-{7-fluoro-4-oxo-4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl}butanamide

E228-2811 Screening compound: N-[2-(3,4-diethoxyphenyl)ethyl]-4-{7-fluoro-4-oxo-4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl}butanamide
E228-2811 Screening compound: N-[2-(3,4-diethoxyphenyl)ethyl]-4-{7-fluoro-4-oxo-4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl}butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E228-2811
N-[2-(3,4-diethoxyphenyl)ethyl]-4-{7-fluoro-4-oxo-4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl}butanamide

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

E228-2811

Molecular Formula

C27H30FN3O4 (C27 H30 FN3 O4)

Compound Name

N-[2-(3,4-diethoxyphenyl)ethyl]-4-{7-fluoro-4-oxo-4H,5H-pyrrolo[1,2-a]quinoxalin-5-yl}butanamide

IUPAC name

N-[2-(34-diethoxyphenyl)ethyl]-4-{7-fluoro-4-oxo-4H5H-pyrrolo[12-a]quinoxalin-5-yl}butanamide

SMILES

CCOc(ccc(CCNC(CCCN(c(cc(cc1)F)c1-n1c2ccc1)C2=O)=O)c1)c1OCC

InChI

InChI=1S/C27H30FN3O4/c1-3-34-24-12-9-19(17-25(24)35-4-2)13-14-29-26(32)8-6-16-31-23-18-20(28)10-11-21(23)30-15-5-7-22(30)27(31)33/h5,7,9-12,15,17-18H,3-4,6,8,13-14,16H2,1-2H3,(H,29,32)

InChI Key

BCWJXTCOKWKTEL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14850205

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

479.55

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

12.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.760

Distribution Coefficient, logD

2.760

Water Solubility, LogSw

-3.17

Polar Surface Area

55.677

Acid Dissociation Constant (pKa)

14.38

Base Dissociation Constant (pKb)

0.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

E228-2811 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

Antimitotic Tubulin Library (17355 compounds)

Regenerative Medicine Focused Library (23016 compounds)

Therapeutical Diversity Annotated Library (7563 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds

References: we are preparing a list of scientific research reports with E228-2811 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E228-2811?
Check Price and Availability of E228-2811, 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 E228-2811 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E228-2811
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E228-2811
  • 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 E228-2811 available by request