6782-0922 Screening compound: 5-[(2-bromo-4-tert-butylphenoxy)methyl]-3-(3-methylphenyl)-1,2,4-oxadiazole

6782-0922 Screening compound: 5-[(2-bromo-4-tert-butylphenoxy)methyl]-3-(3-methylphenyl)-1,2,4-oxadiazole
6782-0922 Screening compound: 5-[(2-bromo-4-tert-butylphenoxy)methyl]-3-(3-methylphenyl)-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 6782-0922
5-[(2-bromo-4-tert-butylphenoxy)methyl]-3-(3-methylphenyl)-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

6782-0922

Molecular Formula

C20H21BrN2O2 (C20 H21 BrN2 O2)

Compound Name

5-[(2-bromo-4-tert-butylphenoxy)methyl]-3-(3-methylphenyl)-1,2,4-oxadiazole

IUPAC name

5-[(2-bromo-4-tert-butylphenoxy)methyl]-3-(3-methylphenyl)-124-oxadiazole

SMILES

CC(C)(C)c(cc1)cc(Br)c1OCc1nc(-c2cc(C)ccc2)no1

InChI

InChI=1S/C20H21BrN2O2/c1-13-6-5-7-14(10-13)19-22-18(25-23-19)12-24-17-9-8-15(11-16(17)21)20(2,3)4/h5-11H,12H2,1-4H3

InChI Key

RTYCQFPRLLCEOX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06166269

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

6.670

Distribution Coefficient, logD

6.670

Water Solubility, LogSw

-5.89

Polar Surface Area

38.896

Acid Dissociation Constant (pKa)

27.89

Base Dissociation Constant (pKb)

-5.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

References: we are preparing a list of scientific research reports with 6782-0922 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6782-0922?
Check Price and Availability of 6782-0922, 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 6782-0922 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6782-0922
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6782-0922
  • 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 6782-0922 available by request