L466-0530 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-2-[4-(quinoxalin-2-yl)phenoxy]propanamide

L466-0530 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-2-[4-(quinoxalin-2-yl)phenoxy]propanamide
L466-0530 Screening compound: N-(2H-1,3-benzodioxol-5-yl)-2-[4-(quinoxalin-2-yl)phenoxy]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L466-0530
N-(2H-1,3-benzodioxol-5-yl)-2-[4-(quinoxalin-2-yl)phenoxy]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

L466-0530

Molecular Formula

C24H19N3O4 (C24 H19 N3 O4)

Compound Name

N-(2H-1,3-benzodioxol-5-yl)-2-[4-(quinoxalin-2-yl)phenoxy]propanamide

IUPAC name

N-(2H-13-benzodioxol-5-yl)-2-[4-(quinoxalin-2-yl)phenoxy]propanamide

SMILES

CC(C(Nc(cc1)cc2c1OCO2)=O)Oc(cc1)ccc1-c1nc2ccccc2nc1

InChI

InChI=1S/C24H19N3O4/c1-15(24(28)26-17-8-11-22-23(12-17)30-14-29-22)31-18-9-6-16(7-10-18)21-13-25-19-4-2-3-5-20(19)27-21/h2-13,15H,14H2,1H3,(H,26,28)/t15-/m0/s1

InChI Key

VWHBYDIYEIACOE-HNNXBMFYSA-N

MDL Number (MFCD)

MFCD27254784

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.809

Distribution Coefficient, logD

4.809

Water Solubility, LogSw

-4.45

Polar Surface Area

64.417

Acid Dissociation Constant (pKa)

11.11

Base Dissociation Constant (pKb)

2.94

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

12.50

L466-0530 in Drug Discovery

Included in Screening Libraries

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

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with L466-0530 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L466-0530?
Check Price and Availability of L466-0530, 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 L466-0530 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L466-0530
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L466-0530
  • 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 L466-0530 available by request