4904-3286 Screening compound: 3-{5-[(4-bromo-3-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}pyridine

4904-3286 Screening compound: 3-{5-[(4-bromo-3-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}pyridine
4904-3286 Screening compound: 3-{5-[(4-bromo-3-methylphenoxy)methyl]-1,2,4-oxadiazol-3-yl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound 4904-3286
3-{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

4904-3286

Molecular Formula

C15H12BrN3O2 (C15 H12 BrN3 O2)

Compound Name

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

IUPAC name

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

SMILES

Cc(cc(cc1)OCc2nc(-c3cnccc3)no2)c1Br

InChI

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

InChI Key

PVFSXEOAUNHSOB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01832222

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

3.750

Distribution Coefficient, logD

3.112

Water Solubility, LogSw

-3.74

Polar Surface Area

48.327

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

7.93

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

References: we are preparing a list of scientific research reports with 4904-3286 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4904-3286?
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What is the minimum amount of 4904-3286 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4904-3286
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4904-3286
  • 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 4904-3286 available by request