S550-0124 Screening compound: 2-methyl-N-{[8-(3-propyl-1,2,4-oxadiazol-5-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}benzamide

S550-0124 Screening compound: 2-methyl-N-{[8-(3-propyl-1,2,4-oxadiazol-5-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}benzamide
S550-0124 Screening compound: 2-methyl-N-{[8-(3-propyl-1,2,4-oxadiazol-5-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S550-0124
2-methyl-N-{[8-(3-propyl-1,2,4-oxadiazol-5-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}benzamide

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

S550-0124

Molecular Formula

C20H20N6O2 (C20 H20 N6 O2)

Compound Name

2-methyl-N-{[8-(3-propyl-1,2,4-oxadiazol-5-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl}benzamide

IUPAC name

2-methyl-N-{[8-(3-propyl-124-oxadiazol-5-yl)-[124]triazolo[43-a]pyridin-3-yl]methyl}benzamide

SMILES

CCCc1noc(-c2cccn3c2nnc3CNC(c2c(C)cccc2)=O)n1

InChI

InChI=1S/C20H20N6O2/c1-3-7-16-22-20(28-25-16)15-10-6-11-26-17(23-24-18(15)26)12-21-19(27)14-9-5-4-8-13(14)2/h4-6,8-11H,3,7,12H2,1-2H3,(H,21,27)

InChI Key

DUABTSDCACYYNM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29009224

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.681

Distribution Coefficient, logD

2.681

Water Solubility, LogSw

-3.01

Polar Surface Area

80.452

Acid Dissociation Constant (pKa)

10.89

Base Dissociation Constant (pKb)

-5.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

S550-0124 in Drug Discovery

Included in Screening Libraries

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Histone Deacetylases (HDAC) Targeted Library (9760 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Epigenetic
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Endocrine
  • Immune system

References: we are preparing a list of scientific research reports with S550-0124 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S550-0124?
Check Price and Availability of S550-0124, 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 S550-0124 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S550-0124
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S550-0124
  • 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 S550-0124 available by request