4534-2757 Screening compound: 2-{5-[(4-bromo-3-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}pyridine

4534-2757 Screening compound: 2-{5-[(4-bromo-3-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}pyridine
4534-2757 Screening compound: 2-{5-[(4-bromo-3-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4534-2757
2-{5-[(4-bromo-3-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}pyridine

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

4534-2757

Molecular Formula

C15H12BrN3O2 (C15 H12 BrN3 O2)

Compound Name

2-{5-[(4-bromo-3-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}pyridine

IUPAC name

2-{5-[(4-bromo-3-methylphenoxy)methyl]-124-oxadiazol-3-yl}pyridine

SMILES

Cc(cc(cc1)OCc2nc(-c3ncccc3)no2)c1Br

InChI

InChI=1S/C15H12BrN3O2/c1-10-8-11(5-6-12(10)16)20-9-14-18-15(19-21-14)13-4-2-3-7-17-13/h2-8H,9H2,1H3

InChI Key

OXBJWTRGGFXHKB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02637151

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.18

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.855

Distribution Coefficient, logD

3.855

Water Solubility, LogSw

-3.94

Polar Surface Area

47.857

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

2.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

References: we are preparing a list of scientific research reports with 4534-2757 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4534-2757?
Check Price and Availability of 4534-2757, 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 4534-2757 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4534-2757
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4534-2757
  • 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 4534-2757 available by request