L866-0406 Screening compound: 3-(4-{[(2-ethyl-6-methylphenyl)carbamoyl]methyl}-3-oxo-3,4-dihydroquinoxalin-2-yl)-N-propylpropanamide

L866-0406 Screening compound: 3-(4-{[(2-ethyl-6-methylphenyl)carbamoyl]methyl}-3-oxo-3,4-dihydroquinoxalin-2-yl)-N-propylpropanamide
L866-0406 Screening compound: 3-(4-{[(2-ethyl-6-methylphenyl)carbamoyl]methyl}-3-oxo-3,4-dihydroquinoxalin-2-yl)-N-propylpropanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L866-0406
3-(4-{[(2-ethyl-6-methylphenyl)carbamoyl]methyl}-3-oxo-3,4-dihydroquinoxalin-2-yl)-N-propylpropanamide

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

L866-0406

Molecular Formula

C25H30N4O3 (C25 H30 N4 O3)

Compound Name

3-(4-{[(2-ethyl-6-methylphenyl)carbamoyl]methyl}-3-oxo-3,4-dihydroquinoxalin-2-yl)-N-propylpropanamide

IUPAC name

3-(4-{[(2-ethyl-6-methylphenyl)carbamoyl]methyl}-3-oxo-34-dihydroquinoxalin-2-yl)-N-propylpropanamide

SMILES

CCCNC(CCC1=Nc(cccc2)c2N(CC(Nc2c(CC)cccc2C)=O)C1=O)=O

InChI

InChI=1S/C25H30N4O3/c1-4-15-26-22(30)14-13-20-25(32)29(21-12-7-6-11-19(21)27-20)16-23(31)28-24-17(3)9-8-10-18(24)5-2/h6-12H,4-5,13-16H2,1-3H3,(H,26,30)(H,28,31)

InChI Key

VEEXRNMLJWSFTD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27482841

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

434.54

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

11.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.704

Distribution Coefficient, logD

2.704

Water Solubility, LogSw

-2.72

Polar Surface Area

69.420

Acid Dissociation Constant (pKa)

12.66

Base Dissociation Constant (pKb)

1.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

36.00

L866-0406 in Drug Discovery

Included in Screening Libraries

Eccentric PPI Library (11937 compounds)

Immunological Library (6760 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Cyclic compounds
Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with L866-0406 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L866-0406?
Check Price and Availability of L866-0406, 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 L866-0406 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L866-0406
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L866-0406
  • 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 L866-0406 available by request