8010-4839 Screening compound: 1-{[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetone

8010-4839 Screening compound: 1-{[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetone
8010-4839 Screening compound: 1-{[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetone alternative view

Chemical Structure Depiction of ChemDiv screening compound 8010-4839
1-{[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetone

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

8010-4839

Molecular Formula

C11H9BrN2O2S (C11 H9 BrN2 O2 S)

Compound Name

1-{[5-(3-bromophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}acetone

IUPAC name

1-{[5-(3-bromophenyl)-134-oxadiazol-2-yl]sulfanyl}propan-2-one

SMILES

CC(CSc1nnc(-c2cccc(Br)c2)o1)=O

InChI

InChI=1S/C11H9BrN2O2S/c1-7(15)6-17-11-14-13-10(16-11)8-3-2-4-9(12)5-8/h2-5H,6H2,1H3

InChI Key

MGEJDKRUCUXZAS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02029667

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

313.17

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.528

Distribution Coefficient, logD

2.528

Water Solubility, LogSw

-2.59

Polar Surface Area

43.671

Acid Dissociation Constant (pKa)

18.03

Base Dissociation Constant (pKb)

-4.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.18

8010-4839 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

GABA Library (7115 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Eye
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Agro:
  • Agro
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands
  • Epigenetic

References: we are preparing a list of scientific research reports with 8010-4839 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8010-4839?
Check Price and Availability of 8010-4839, 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 8010-4839 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8010-4839
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8010-4839
  • 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 8010-4839 available by request