4581-1343 Screening compound: 5-(3-nitrophenyl)-3-phenyl-1,2,4-oxadiazole

4581-1343 Screening compound: 5-(3-nitrophenyl)-3-phenyl-1,2,4-oxadiazole
4581-1343 Screening compound: 5-(3-nitrophenyl)-3-phenyl-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 4581-1343
5-(3-nitrophenyl)-3-phenyl-1,2,4-oxadiazole

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

4581-1343

Molecular Formula

C14H9N3O3 (C14 H9 N3 O3)

Compound Name

5-(3-nitrophenyl)-3-phenyl-1,2,4-oxadiazole

IUPAC name

5-(3-nitrophenyl)-3-phenyl-124-oxadiazole

SMILES

[O-][N+](c1cc(-c2nc(-c3ccccc3)no2)ccc1)=O

InChI

InChI=1S/C14H9N3O3/c18-17(19)12-8-4-7-11(9-12)14-15-13(16-20-14)10-5-2-1-3-6-10/h1-9H

InChI Key

XLFCFHWQTFKPFS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00426945

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

267.24

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.972

Distribution Coefficient, logD

3.972

Water Solubility, LogSw

-4.33

Polar Surface Area

65.026

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-6.71

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

4581-1343 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Antiviral Annotated Library (21441 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Agro:
  • Agro
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 4581-1343 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4581-1343?
Check Price and Availability of 4581-1343, 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 4581-1343 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4581-1343
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4581-1343
  • 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 4581-1343 available by request