S050-0160 Screening compound: 2-FURYL{3-[4-(3-METHYL-1,2,4-OXADIAZOL-5-YL)PHENOXY]-1-AZETANYL}METHANONE

S050-0160 Screening compound: 2-FURYL{3-[4-(3-METHYL-1,2,4-OXADIAZOL-5-YL)PHENOXY]-1-AZETANYL}METHANONE
S050-0160 Screening compound: 2-FURYL{3-[4-(3-METHYL-1,2,4-OXADIAZOL-5-YL)PHENOXY]-1-AZETANYL}METHANONE alternative view

Chemical Structure Depiction of ChemDiv screening compound S050-0160
2-FURYL{3-[4-(3-METHYL-1,2,4-OXADIAZOL-5-YL)PHENOXY]-1-AZETANYL}METHANONE

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

S050-0160

Molecular Formula

C17H15N3O4 (C17 H15 N3 O4)

Compound Name

2-FURYL{3-[4-(3-METHYL-1,2,4-OXADIAZOL-5-YL)PHENOXY]-1-AZETANYL}METHANONE

IUPAC name

n/a

SMILES

Cc1noc(-c(cc2)ccc2OC(C2)CN2C(c2ccco2)=O)n1

InChI

InChI=1S/C17H15N3O4/c1-11-18-16(24-19-11)12-4-6-13(7-5-12)23-14-9-20(10-14)17(21)15-3-2-8-22-15/h2-8,14H,9-10H2,1H3

InChI Key

NGKPVEIINOBRGH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29007965

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

325.32

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.916

Distribution Coefficient, logD

1.916

Water Solubility, LogSw

-2.16

Polar Surface Area

63.215

Acid Dissociation Constant (pKa)

28.41

Base Dissociation Constant (pKb)

-0.64

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

23.50

S050-0160 in Drug Discovery

Included in Screening Libraries

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

Mechanism of action:
  • PPI modulators
  • PPI modulators
  • PPI modulators
  • Epigenetic
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds
  • Mimetics
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Female
  • Hemic and lymphatic
  • Cardiovascular

References: we are preparing a list of scientific research reports with S050-0160 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S050-0160?
Check Price and Availability of S050-0160, 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 S050-0160 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S050-0160
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S050-0160
  • 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 S050-0160 available by request