SA72-0444 Screening compound: 2-[4-(2-methoxyethyl)-4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]quinoline

SA72-0444 Screening compound: 2-[4-(2-methoxyethyl)-4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]quinoline
SA72-0444 Screening compound: 2-[4-(2-methoxyethyl)-4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]quinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound SA72-0444
2-[4-(2-methoxyethyl)-4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]quinoline

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

SA72-0444

Molecular Formula

C21H24N4O3 (C21 H24 N4 O3)

Compound Name

2-[4-(2-methoxyethyl)-4-(5-methyl-1,2,4-oxadiazol-3-yl)piperidine-1-carbonyl]quinoline

IUPAC name

2-[4-(2-methoxyethyl)-4-(5-methyl-124-oxadiazol-3-yl)piperidine-1-carbonyl]quinoline

SMILES

Cc1nc(C(CCOC)(CC2)CCN2C(c2nc3ccccc3cc2)=O)no1

InChI

InChI=1S/C21H24N4O3/c1-15-22-20(24-28-15)21(11-14-27-2)9-12-25(13-10-21)19(26)18-8-7-16-5-3-4-6-17(16)23-18/h3-8H,9-14H2,1-2H3

InChI Key

UDYMDWARXWAVJZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32241093

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.738

Distribution Coefficient, logD

2.738

Water Solubility, LogSw

-3.06

Polar Surface Area

64.465

Acid Dissociation Constant (pKa)

27.50

Base Dissociation Constant (pKb)

0.31

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.86

SA72-0444 in Drug Discovery

Included in Screening Libraries

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with SA72-0444 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA72-0444?
Check Price and Availability of SA72-0444, 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 SA72-0444 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA72-0444
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA72-0444
  • 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 SA72-0444 available by request