L466-0087 Screening compound: 2-[4-(quinoxalin-2-yl)phenoxy]-1-(1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-one

L466-0087 Screening compound: 2-[4-(quinoxalin-2-yl)phenoxy]-1-(1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-one
L466-0087 Screening compound: 2-[4-(quinoxalin-2-yl)phenoxy]-1-(1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound L466-0087
2-[4-(quinoxalin-2-yl)phenoxy]-1-(1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-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

L466-0087

Molecular Formula

C25H21N3O2 (C25 H21 N3 O2)

Compound Name

2-[4-(quinoxalin-2-yl)phenoxy]-1-(1,2,3,4-tetrahydroquinolin-1-yl)ethan-1-one

IUPAC name

2-[4-(quinoxalin-2-yl)phenoxy]-1-(1234-tetrahydroquinolin-1-yl)ethan-1-one

SMILES

O=C(COc(cc1)ccc1-c1nc2ccccc2nc1)N(CCC1)c2c1cccc2

InChI

InChI=1S/C25H21N3O2/c29-25(28-15-5-7-19-6-1-4-10-24(19)28)17-30-20-13-11-18(12-14-20)23-16-26-21-8-2-3-9-22(21)27-23/h1-4,6,8-14,16H,5,7,15,17H2

InChI Key

LJCSDSGDAQJKQW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27254659

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

395.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.997

Distribution Coefficient, logD

4.997

Water Solubility, LogSw

-4.72

Polar Surface Area

39.706

Acid Dissociation Constant (pKa)

23.65

Base Dissociation Constant (pKb)

2.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.00

L466-0087 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with L466-0087 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L466-0087?
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What is the minimum amount of L466-0087 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L466-0087
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L466-0087
  • 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 L466-0087 available by request