5220-0470 Screening compound: 5-[(2-methylphenoxy)methyl]-3-phenyl-1,2,4-oxadiazole

5220-0470 Screening compound: 5-[(2-methylphenoxy)methyl]-3-phenyl-1,2,4-oxadiazole
5220-0470 Screening compound: 5-[(2-methylphenoxy)methyl]-3-phenyl-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 5220-0470
5-[(2-methylphenoxy)methyl]-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

5220-0470

Molecular Formula

C16H14N2O2 (C16 H14 N2 O2)

Compound Name

5-[(2-methylphenoxy)methyl]-3-phenyl-1,2,4-oxadiazole

IUPAC name

5-[(2-methylphenoxy)methyl]-3-phenyl-124-oxadiazole

SMILES

Cc(cccc1)c1OCc1nc(-c2ccccc2)no1

InChI

InChI=1S/C16H14N2O2/c1-12-7-5-6-10-14(12)19-11-15-17-16(18-20-15)13-8-3-2-4-9-13/h2-10H,11H2,1H3

InChI Key

TXLKCBKTDQGTRD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02636933

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

266.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.377

Distribution Coefficient, logD

4.377

Water Solubility, LogSw

-4.54

Polar Surface Area

38.896

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

-5.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

5220-0470 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Annotated Library (21441 compounds)

CNS targets activity set (6557 compounds)

Human GPCR Annotated Library (5539 compounds)

Human Receptors Annotated Library (5376 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 5220-0470 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5220-0470?
Check Price and Availability of 5220-0470, 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 5220-0470 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5220-0470
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5220-0470
  • 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 5220-0470 available by request