S343-0067 Screening compound: 1-(4-chlorophenyl)-4-[5-(3,5-dimethylphenyl)-1,2,4-oxadiazol-3-yl]pyrrolidin-2-one

S343-0067 Screening compound: 1-(4-chlorophenyl)-4-[5-(3,5-dimethylphenyl)-1,2,4-oxadiazol-3-yl]pyrrolidin-2-one
S343-0067 Screening compound: 1-(4-chlorophenyl)-4-[5-(3,5-dimethylphenyl)-1,2,4-oxadiazol-3-yl]pyrrolidin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S343-0067
1-(4-chlorophenyl)-4-[5-(3,5-dimethylphenyl)-1,2,4-oxadiazol-3-yl]pyrrolidin-2-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

S343-0067

Molecular Formula

C20H18ClN3O2 (C20 H18 ClN3 O2)

Compound Name

1-(4-chlorophenyl)-4-[5-(3,5-dimethylphenyl)-1,2,4-oxadiazol-3-yl]pyrrolidin-2-one

IUPAC name

1-(4-chlorophenyl)-4-[5-(35-dimethylphenyl)-124-oxadiazol-3-yl]pyrrolidin-2-one

SMILES

Cc1cc(-c2nc(C(CC3=O)CN3c(cc3)ccc3Cl)no2)cc(C)c1

InChI

InChI=1S/C20H18ClN3O2/c1-12-7-13(2)9-14(8-12)20-22-19(23-26-20)15-10-18(25)24(11-15)17-5-3-16(21)4-6-17/h3-9,15H,10-11H2,1-2H3/t15-/m1/s1

InChI Key

RCJPBESSSPKVQQ-OAHLLOKOSA-N

MDL Number (MFCD)

MFCD28998571

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

367.83

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.684

Distribution Coefficient, logD

4.684

Water Solubility, LogSw

-4.77

Polar Surface Area

48.394

Acid Dissociation Constant (pKa)

11.87

Base Dissociation Constant (pKb)

-2.71

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

25.00

S343-0067 in Drug Discovery

Included in Screening Libraries

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

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

Protein-Protein Interaction Library (218420 compounds)

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

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with S343-0067 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S343-0067?
Check Price and Availability of S343-0067, 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 S343-0067 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S343-0067
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S343-0067
  • 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 S343-0067 available by request