L829-0111 Screening compound: 5-(3,4-diethoxyphenyl)-3-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazole

L829-0111 Screening compound: 5-(3,4-diethoxyphenyl)-3-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazole
L829-0111 Screening compound: 5-(3,4-diethoxyphenyl)-3-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound L829-0111
5-(3,4-diethoxyphenyl)-3-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-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

L829-0111

Molecular Formula

C22H21N3O3S (C22 H21 N3 O3 S)

Compound Name

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

IUPAC name

5-(34-diethoxyphenyl)-3-[3-(2-methyl-13-thiazol-4-yl)phenyl]-124-oxadiazole

SMILES

CCOc(ccc(-c1nc(-c2cccc(-c3csc(C)n3)c2)no1)c1)c1OCC

InChI

InChI=1S/C22H21N3O3S/c1-4-26-19-10-9-17(12-20(19)27-5-2)22-24-21(25-28-22)16-8-6-7-15(11-16)18-13-29-14(3)23-18/h6-13H,4-5H2,1-3H3

InChI Key

JSDZGMUQTCSVBQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27478632

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

407.49

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

5.401

Distribution Coefficient, logD

5.401

Water Solubility, LogSw

-5.62

Polar Surface Area

55.605

Acid Dissociation Constant (pKa)

29.85

Base Dissociation Constant (pKb)

2.57

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

22.70

L829-0111 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with L829-0111 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L829-0111?
Check Price and Availability of L829-0111, 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 L829-0111 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L829-0111
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L829-0111
  • 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 L829-0111 available by request