SA65-1126 Screening compound: 1-(4-{2-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]ethyl}piperidin-1-yl)-2-(thiophen-2-yl)ethan-1-one

SA65-1126 Screening compound: 1-(4-{2-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]ethyl}piperidin-1-yl)-2-(thiophen-2-yl)ethan-1-one
SA65-1126 Screening compound: 1-(4-{2-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]ethyl}piperidin-1-yl)-2-(thiophen-2-yl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound SA65-1126
1-(4-{2-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]ethyl}piperidin-1-yl)-2-(thiophen-2-yl)ethan-1-one

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

SA65-1126

Molecular Formula

C20H27N3O3S (C20 H27 N3 O3 S)

Compound Name

1-(4-{2-[5-(oxan-4-yl)-1,2,4-oxadiazol-3-yl]ethyl}piperidin-1-yl)-2-(thiophen-2-yl)ethan-1-one

IUPAC name

1-(4-{2-[5-(oxan-4-yl)-124-oxadiazol-3-yl]ethyl}piperidin-1-yl)-2-(thiophen-2-yl)ethan-1-one

SMILES

O=C(Cc1cccs1)N1CCC(CCc2noc(C3CCOCC3)n2)CC1

InChI

InChI=1S/C20H27N3O3S/c24-19(14-17-2-1-13-27-17)23-9-5-15(6-10-23)3-4-18-21-20(26-22-18)16-7-11-25-12-8-16/h1-2,13,15-16H,3-12,14H2

InChI Key

IYFVPRCBLLTCFT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD32002462

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.52

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

3.313

Distribution Coefficient, logD

3.313

Water Solubility, LogSw

-3.25

Polar Surface Area

57.875

Acid Dissociation Constant (pKa)

22.63

Base Dissociation Constant (pKb)

0.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

65.00

SA65-1126 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with SA65-1126 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA65-1126?
Check Price and Availability of SA65-1126, 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 SA65-1126 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA65-1126
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA65-1126
  • 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 SA65-1126 available by request