8013-3610 Screening compound: 4-{4-[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]phenoxy}phenyl furan-2-carboxylate

8013-3610 Screening compound: 4-{4-[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]phenoxy}phenyl furan-2-carboxylate
8013-3610 Screening compound: 4-{4-[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]phenoxy}phenyl furan-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8013-3610
4-{4-[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]phenoxy}phenyl furan-2-carboxylate

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

8013-3610

Molecular Formula

C23H14N2O6 (C23 H14 N2 O6)

Compound Name

4-{4-[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]phenoxy}phenyl furan-2-carboxylate

IUPAC name

4-{4-[5-(furan-2-yl)-124-oxadiazol-3-yl]phenoxy}phenyl furan-2-carboxylate

SMILES

O=C(c1ccco1)Oc(cc1)ccc1Oc(cc1)ccc1-c1noc(-c2ccco2)n1

InChI

InChI=1S/C23H14N2O6/c26-23(20-4-2-14-28-20)30-18-11-9-17(10-12-18)29-16-7-5-15(6-8-16)21-24-22(31-25-21)19-3-1-13-27-19/h1-14H

InChI Key

DNLJYKMXXYZNGY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03766203

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

414.37

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

5.197

Distribution Coefficient, logD

5.197

Water Solubility, LogSw

-5.59

Polar Surface Area

75.927

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

-5.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8013-3610 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 8013-3610 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8013-3610?
Check Price and Availability of 8013-3610, 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 8013-3610 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8013-3610
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8013-3610
  • 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 8013-3610 available by request