SA66-0752 Screening compound: 3-(3-{2-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]ethyl}piperidine-1-carbonyl)-2-methylpyridine

SA66-0752 Screening compound: 3-(3-{2-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]ethyl}piperidine-1-carbonyl)-2-methylpyridine
SA66-0752 Screening compound: 3-(3-{2-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]ethyl}piperidine-1-carbonyl)-2-methylpyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound SA66-0752
3-(3-{2-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]ethyl}piperidine-1-carbonyl)-2-methylpyridine

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

SA66-0752

Molecular Formula

C22H23FN4O2 (C22 H23 FN4 O2)

Compound Name

3-(3-{2-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]ethyl}piperidine-1-carbonyl)-2-methylpyridine

IUPAC name

3-(3-{2-[5-(4-fluorophenyl)-124-oxadiazol-3-yl]ethyl}piperidine-1-carbonyl)-2-methylpyridine

SMILES

Cc(nccc1)c1C(N1CC(CCc2noc(-c(cc3)ccc3F)n2)CCC1)=O

InChI

InChI=1S/C22H23FN4O2/c1-15-19(5-2-12-24-15)22(28)27-13-3-4-16(14-27)6-11-20-25-21(29-26-20)17-7-9-18(23)10-8-17/h2,5,7-10,12,16H,3-4,6,11,13-14H2,1H3/t16-/m1/s1

InChI Key

WSENHOLQZCKLKN-MRXNPFEDSA-N

MDL Number (MFCD)

MFCD32001389

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

394.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.560

Distribution Coefficient, logD

3.560

Water Solubility, LogSw

-3.68

Polar Surface Area

58.841

Acid Dissociation Constant (pKa)

25.07

Base Dissociation Constant (pKb)

4.18

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.36

SA66-0752 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

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

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

References: we are preparing a list of scientific research reports with SA66-0752 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA66-0752?
Check Price and Availability of SA66-0752, 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 SA66-0752 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA66-0752
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA66-0752
  • 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 SA66-0752 available by request