8016-3648 Screening compound: 4-{5-[(2,4-difluorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}pyridine

8016-3648 Screening compound: 4-{5-[(2,4-difluorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}pyridine
8016-3648 Screening compound: 4-{5-[(2,4-difluorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8016-3648
4-{5-[(2,4-difluorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}pyridine

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

8016-3648

Molecular Formula

C14H9F2N3O2 (C14 H9 F2 N3 O2)

Compound Name

4-{5-[(2,4-difluorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}pyridine

IUPAC name

4-{5-[(24-difluorophenoxy)methyl]-124-oxadiazol-3-yl}pyridine

SMILES

Fc(cc1)cc(F)c1OCc1nc(-c2ccncc2)no1

InChI

InChI=1S/C14H9F2N3O2/c15-10-1-2-12(11(16)7-10)20-8-13-18-14(19-21-13)9-3-5-17-6-4-9/h1-7H,8H2

InChI Key

BXCCFKPQNIKAGQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05855769

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

289.24

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.863

Distribution Coefficient, logD

2.863

Water Solubility, LogSw

-2.85

Polar Surface Area

48.324

Acid Dissociation Constant (pKa)

31.04

Base Dissociation Constant (pKb)

3.68

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.14

8016-3648 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Receptors Annotated Library (5376 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 8016-3648 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8016-3648?
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What is the minimum amount of 8016-3648 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8016-3648
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8016-3648
  • 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 8016-3648 available by request