L829-0080 Screening compound: 2-{3-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazol-5-yl}pyridine

L829-0080 Screening compound: 2-{3-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazol-5-yl}pyridine
L829-0080 Screening compound: 2-{3-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazol-5-yl}pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound L829-0080
2-{3-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazol-5-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

L829-0080

Molecular Formula

C17H12N4OS (C17 H12 N4 OS)

Compound Name

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

IUPAC name

2-{3-[3-(2-methyl-13-thiazol-4-yl)phenyl]-124-oxadiazol-5-yl}pyridine

SMILES

Cc1nc(-c2cc(-c3noc(-c4ncccc4)n3)ccc2)cs1

InChI

InChI=1S/C17H12N4OS/c1-11-19-15(10-23-11)12-5-4-6-13(9-12)16-20-17(22-21-16)14-7-2-3-8-18-14/h2-10H,1H3

InChI Key

PZPSKERKEHOXLD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27478619

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

320.37

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.228

Distribution Coefficient, logD

4.228

Water Solubility, LogSw

-4.53

Polar Surface Area

50.232

Acid Dissociation Constant (pKa)

35.12

Base Dissociation Constant (pKb)

2.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.90

L829-0080 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Immunological Library (6760 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Immune system
Agro:
  • Agro

References: we are preparing a list of scientific research reports with L829-0080 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L829-0080?
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What is the minimum amount of L829-0080 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L829-0080
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L829-0080
  • 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 L829-0080 available by request