S051-0214 Screening compound: 4-{3-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carbonyl}-1H-indole

S051-0214 Screening compound: 4-{3-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carbonyl}-1H-indole
S051-0214 Screening compound: 4-{3-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carbonyl}-1H-indole alternative view

Chemical Structure Depiction of ChemDiv screening compound S051-0214
4-{3-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carbonyl}-1H-indole

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

S051-0214

Molecular Formula

C26H20N4O3 (C26 H20 N4 O3)

Compound Name

4-{3-[3-(3-phenyl-1,2,4-oxadiazol-5-yl)phenoxy]azetidine-1-carbonyl}-1H-indole

IUPAC name

4-{3-[3-(3-phenyl-124-oxadiazol-5-yl)phenoxy]azetidine-1-carbonyl}-1H-indole

SMILES

O=C(c1c(cc[nH]2)c2ccc1)N(C1)CC1Oc1cc(-c2nc(-c3ccccc3)no2)ccc1

InChI

InChI=1S/C26H20N4O3/c31-26(22-10-5-11-23-21(22)12-13-27-23)30-15-20(16-30)32-19-9-4-8-18(14-19)25-28-24(29-33-25)17-6-2-1-3-7-17/h1-14,20,27H,15-16H2

InChI Key

NJOCTYXLPBECIT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29008742

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

436.47

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.598

Distribution Coefficient, logD

4.598

Water Solubility, LogSw

-4.53

Polar Surface Area

64.533

Acid Dissociation Constant (pKa)

17.81

Base Dissociation Constant (pKb)

0.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.50

S051-0214 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Antiviral Library (67538 compounds)

Indole Derivatives (10091 compounds)

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

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Inhibitors of beta-Catenin Signaling (7445 compounds)

MEF2-HDAC (class II) Modulators Library (5147 compounds)

Peptidomimetic Library (37031 compounds)

SH2 PTB Focused Library (6188 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Cyclic compounds
  • Mimetics
  • Cyclic compounds
  • Mimetics
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Musculoskeletal
  • Female
  • Hemic and lymphatic
  • Cardiovascular
Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • Epigenetic
  • PPI modulators

References: we are preparing a list of scientific research reports with S051-0214 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S051-0214?
Check Price and Availability of S051-0214, 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 S051-0214 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S051-0214
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S051-0214
  • 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 S051-0214 available by request