L829-0171 Screening compound: 3-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-5-(2-phenylethyl)-1,2,4-oxadiazole

L829-0171 Screening compound: 3-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-5-(2-phenylethyl)-1,2,4-oxadiazole
L829-0171 Screening compound: 3-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-5-(2-phenylethyl)-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound L829-0171
3-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-5-(2-phenylethyl)-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

L829-0171

Molecular Formula

C20H17N3OS (C20 H17 N3 OS)

Compound Name

3-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-5-(2-phenylethyl)-1,2,4-oxadiazole

IUPAC name

3-[3-(2-methyl-13-thiazol-4-yl)phenyl]-5-(2-phenylethyl)-124-oxadiazole

SMILES

Cc1nc(-c2cc(-c3noc(CCc4ccccc4)n3)ccc2)cs1

InChI

InChI=1S/C20H17N3OS/c1-14-21-18(13-25-14)16-8-5-9-17(12-16)20-22-19(24-23-20)11-10-15-6-3-2-4-7-15/h2-9,12-13H,10-11H2,1H3

InChI Key

MOHXIBFANHDOON-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27478662

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

347.44

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

5.936

Distribution Coefficient, logD

5.936

Water Solubility, LogSw

-5.76

Polar Surface Area

40.850

Acid Dissociation Constant (pKa)

26.13

Base Dissociation Constant (pKb)

2.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

L829-0171 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anti-Inflammatory Library (24602 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with L829-0171 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L829-0171?
Check Price and Availability of L829-0171, 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 L829-0171 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L829-0171
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L829-0171
  • 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 L829-0171 available by request