5631-1281 Screening compound: 5-(3,4-dimethylphenyl)-3-(4-methylphenyl)-1,2,4-oxadiazole

5631-1281 Screening compound: 5-(3,4-dimethylphenyl)-3-(4-methylphenyl)-1,2,4-oxadiazole
5631-1281 Screening compound: 5-(3,4-dimethylphenyl)-3-(4-methylphenyl)-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 5631-1281
5-(3,4-dimethylphenyl)-3-(4-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

5631-1281

Molecular Formula

C17H16N2O (C17 H16 N2 O)

Compound Name

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

IUPAC name

5-(34-dimethylphenyl)-3-(4-methylphenyl)-124-oxadiazole

SMILES

Cc(cc1)ccc1-c1noc(-c2cc(C)c(C)cc2)n1

InChI

InChI=1S/C17H16N2O/c1-11-4-7-14(8-5-11)16-18-17(20-19-16)15-9-6-12(2)13(3)10-15/h4-10H,1-3H3

InChI Key

ZOMMWBFNUBIYAG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04019651

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

264.33

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

5.541

Distribution Coefficient, logD

5.541

Water Solubility, LogSw

-5.51

Polar Surface Area

31.644

Acid Dissociation Constant (pKa)

27.55

Base Dissociation Constant (pKb)

-3.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

5631-1281 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anti-infective Library (19449 compounds)

Cardiovascular Library (22201 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 5631-1281 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5631-1281?
Check Price and Availability of 5631-1281, 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 5631-1281 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5631-1281
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5631-1281
  • 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 5631-1281 available by request