C066-5406 Screening compound: 3-(4-fluorophenyl)-1,2,4-oxadiazol-5-ol

C066-5406 Screening compound: 3-(4-fluorophenyl)-1,2,4-oxadiazol-5-ol
C066-5406 Screening compound: 3-(4-fluorophenyl)-1,2,4-oxadiazol-5-ol alternative view

Chemical Structure Depiction of ChemDiv screening compound C066-5406
3-(4-fluorophenyl)-1,2,4-oxadiazol-5-ol

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

C066-5406

Molecular Formula

C8H5FN2O2 (C8 H5 FN2 O2)

Compound Name

3-(4-fluorophenyl)-1,2,4-oxadiazol-5-ol

IUPAC name

3-(4-fluorophenyl)-124-oxadiazol-5-ol

SMILES

Oc1nc(-c(cc2)ccc2F)no1

InChI

InChI=1S/C8H5FN2O2/c9-6-3-1-5(2-4-6)7-10-8(12)13-11-7/h1-4H,(H,10,11,12)

InChI Key

ZBECIGMDRLTGJI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14281651

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

180.14

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.839

Distribution Coefficient, logD

-2.862

Water Solubility, LogSw

-1.88

Polar Surface Area

47.282

Acid Dissociation Constant (pKa)

2.70

Base Dissociation Constant (pKb)

-4.79

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

C066-5406 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Fragments Library (11262 compounds)

GABA Library (7115 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Eye
Structure:
  • Fragments
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C066-5406 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C066-5406?
Check Price and Availability of C066-5406, 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 C066-5406 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C066-5406
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C066-5406
  • 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 C066-5406 available by request