E594-0463 Screening compound: 6-fluoro-3-(3-phenyl-1,2,4-oxadiazol-5-yl)-2H-chromen-2-one

E594-0463 Screening compound: 6-fluoro-3-(3-phenyl-1,2,4-oxadiazol-5-yl)-2H-chromen-2-one
E594-0463 Screening compound: 6-fluoro-3-(3-phenyl-1,2,4-oxadiazol-5-yl)-2H-chromen-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound E594-0463
6-fluoro-3-(3-phenyl-1,2,4-oxadiazol-5-yl)-2H-chromen-2-one

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

E594-0463

Molecular Formula

C17H9FN2O3 (C17 H9 FN2 O3)

Compound Name

6-fluoro-3-(3-phenyl-1,2,4-oxadiazol-5-yl)-2H-chromen-2-one

IUPAC name

6-fluoro-3-(3-phenyl-124-oxadiazol-5-yl)-2H-chromen-2-one

SMILES

O=C1Oc(ccc(F)c2)c2C=C1c1nc(-c2ccccc2)no1

InChI

InChI=1S/C17H9FN2O3/c18-12-6-7-14-11(8-12)9-13(17(21)22-14)16-19-15(20-23-16)10-4-2-1-3-5-10/h1-9H

InChI Key

OCENXOUQRXJFMZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD10666883

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.27

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.777

Distribution Coefficient, logD

3.777

Water Solubility, LogSw

-4.21

Polar Surface Area

52.566

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-10.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

E594-0463 in Drug Discovery

Included in Screening Libraries

Human Proteases Annotated Library (2868 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with E594-0463 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E594-0463?
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What is the minimum amount of E594-0463 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E594-0463
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E594-0463
  • 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 E594-0463 available by request