E228-1243 Screening compound: 5-(4-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-4-oxobutyl)-4H,5H-pyrrolo[1,2-a]quinoxalin-4-one

E228-1243 Screening compound: 5-(4-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-4-oxobutyl)-4H,5H-pyrrolo[1,2-a]quinoxalin-4-one
E228-1243 Screening compound: 5-(4-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-4-oxobutyl)-4H,5H-pyrrolo[1,2-a]quinoxalin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound E228-1243
5-(4-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-4-oxobutyl)-4H,5H-pyrrolo[1,2-a]quinoxalin-4-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

E228-1243

Molecular Formula

C22H25N3O4 (C22 H25 N3 O4)

Compound Name

5-(4-{1,4-dioxa-8-azaspiro[4.5]decan-8-yl}-4-oxobutyl)-4H,5H-pyrrolo[1,2-a]quinoxalin-4-one

IUPAC name

5-(4-{14-dioxa-8-azaspiro[4.5]decan-8-yl}-4-oxobutyl)-4H5H-pyrrolo[12-a]quinoxalin-4-one

SMILES

O=C(CCCN(c(cccc1)c1-n1c2ccc1)C2=O)N(CC1)CCC11OCCO1

InChI

InChI=1S/C22H25N3O4/c26-20(23-13-9-22(10-14-23)28-15-16-29-22)8-4-12-25-18-6-2-1-5-17(18)24-11-3-7-19(24)21(25)27/h1-3,5-7,11H,4,8-10,12-16H2

InChI Key

IHSQNKREFIJBOT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14849840

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.46

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.654

Distribution Coefficient, logD

1.654

Water Solubility, LogSw

-1.72

Polar Surface Area

47.773

Acid Dissociation Constant (pKa)

23.66

Base Dissociation Constant (pKb)

0.88

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

45.50

E228-1243 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

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

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with E228-1243 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E228-1243?
Check Price and Availability of E228-1243, 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 E228-1243 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E228-1243
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E228-1243
  • 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 E228-1243 available by request