6782-0926 Screening compound: 5-[(2-bromo-4-tert-butylphenoxy)methyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazole

6782-0926 Screening compound: 5-[(2-bromo-4-tert-butylphenoxy)methyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazole
6782-0926 Screening compound: 5-[(2-bromo-4-tert-butylphenoxy)methyl]-3-(4-methoxyphenyl)-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 6782-0926
5-[(2-bromo-4-tert-butylphenoxy)methyl]-3-(4-methoxyphenyl)-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

6782-0926

Molecular Formula

C20H21BrN2O3 (C20 H21 BrN2 O3)

Compound Name

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

IUPAC name

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

SMILES

CC(C)(C)c(cc1)cc(Br)c1OCc1nc(-c(cc2)ccc2OC)no1

InChI

InChI=1S/C20H21BrN2O3/c1-20(2,3)14-7-10-17(16(21)11-14)25-12-18-22-19(23-26-18)13-5-8-15(24-4)9-6-13/h5-11H,12H2,1-4H3

InChI Key

PRPBANXTYMOUQG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04219213

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

417.3

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.283

Distribution Coefficient, logD

6.283

Water Solubility, LogSw

-5.68

Polar Surface Area

46.439

Acid Dissociation Constant (pKa)

30.17

Base Dissociation Constant (pKb)

-6.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

6782-0926 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin

References: we are preparing a list of scientific research reports with 6782-0926 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6782-0926?
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What is the minimum amount of 6782-0926 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6782-0926
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6782-0926
  • 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 6782-0926 available by request