SA92-0535 Screening compound: 3-{3-fluoro-3-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carbonyl}-2,6-dimethoxypyridine

SA92-0535 Screening compound: 3-{3-fluoro-3-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carbonyl}-2,6-dimethoxypyridine
SA92-0535 Screening compound: 3-{3-fluoro-3-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carbonyl}-2,6-dimethoxypyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound SA92-0535
3-{3-fluoro-3-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carbonyl}-2,6-dimethoxypyridine

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

SA92-0535

Molecular Formula

C20H20FN5O4 (C20 H20 FN5 O4)

Compound Name

3-{3-fluoro-3-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carbonyl}-2,6-dimethoxypyridine

IUPAC name

3-{3-fluoro-3-[3-(pyridin-3-yl)-124-oxadiazol-5-yl]piperidine-1-carbonyl}-26-dimethoxypyridine

SMILES

COc(cc1)nc(OC)c1C(N(CCC1)CC1(c1nc(-c2cnccc2)no1)F)=O

InChI

InChI=1S/C20H20FN5O4/c1-28-15-7-6-14(17(23-15)29-2)18(27)26-10-4-8-20(21,12-26)19-24-16(25-30-19)13-5-3-9-22-11-13/h3,5-7,9,11H,4,8,10,12H2,1-2H3/t20-/m0/s1

InChI Key

RCGDLOZSWISFNB-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD32242335

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

413.41

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.686

Distribution Coefficient, logD

2.047

Water Solubility, LogSw

-2.62

Polar Surface Area

82.105

Acid Dissociation Constant (pKa)

27.08

Base Dissociation Constant (pKb)

7.93

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

35.00

SA92-0535 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with SA92-0535 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound SA92-0535?
Check Price and Availability of SA92-0535, 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 SA92-0535 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for SA92-0535
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for SA92-0535
  • 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 SA92-0535 available by request