6652-0761 Screening compound: 3-(4-bromophenyl)-5-(3,5-dimethylphenyl)-1,2,4-oxadiazole

6652-0761 Screening compound: 3-(4-bromophenyl)-5-(3,5-dimethylphenyl)-1,2,4-oxadiazole
6652-0761 Screening compound: 3-(4-bromophenyl)-5-(3,5-dimethylphenyl)-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 6652-0761
3-(4-bromophenyl)-5-(3,5-dimethylphenyl)-1,2,4-oxadiazole

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

6652-0761

Molecular Formula

C16H13BrN2O (C16 H13 BrN2 O)

Compound Name

3-(4-bromophenyl)-5-(3,5-dimethylphenyl)-1,2,4-oxadiazole

IUPAC name

3-(4-bromophenyl)-5-(35-dimethylphenyl)-124-oxadiazole

SMILES

Cc1cc(-c2nc(-c(cc3)ccc3Br)no2)cc(C)c1

InChI

InChI=1S/C16H13BrN2O/c1-10-7-11(2)9-13(8-10)16-18-15(19-20-16)12-3-5-14(17)6-4-12/h3-9H,1-2H3

InChI Key

ZOKRBWXCWDIGQX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04218175

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

329.2

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

5.693

Distribution Coefficient, logD

5.693

Water Solubility, LogSw

-5.60

Polar Surface Area

31.644

Acid Dissociation Constant (pKa)

27.92

Base Dissociation Constant (pKb)

-4.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

6652-0761 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 6652-0761 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6652-0761?
Check Price and Availability of 6652-0761, 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 6652-0761 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6652-0761
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6652-0761
  • 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 6652-0761 available by request