6996-0646 Screening compound: 4-(3-chlorophenyl)-2,3-diphenyl-1,2,4-oxadiazolidin-5-one

6996-0646 Screening compound: 4-(3-chlorophenyl)-2,3-diphenyl-1,2,4-oxadiazolidin-5-one
6996-0646 Screening compound: 4-(3-chlorophenyl)-2,3-diphenyl-1,2,4-oxadiazolidin-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 6996-0646
4-(3-chlorophenyl)-2,3-diphenyl-1,2,4-oxadiazolidin-5-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

6996-0646

Molecular Formula

C20H15ClN2O2 (C20 H15 ClN2 O2)

Compound Name

4-(3-chlorophenyl)-2,3-diphenyl-1,2,4-oxadiazolidin-5-one

IUPAC name

4-(3-chlorophenyl)-23-diphenyl-124-oxadiazolidin-5-one

SMILES

O=C(N(C1c2ccccc2)c2cccc(Cl)c2)ON1c1ccccc1

InChI

InChI=1S/C20H15ClN2O2/c21-16-10-7-13-18(14-16)22-19(15-8-3-1-4-9-15)23(25-20(22)24)17-11-5-2-6-12-17/h1-14,19H/t19-/m0/s1

InChI Key

QUPSUYWJGHGWMZ-IBGZPJMESA-N

MDL Number (MFCD)

MFCD01710522

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

350.8

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.946

Distribution Coefficient, logD

4.946

Water Solubility, LogSw

-5.18

Polar Surface Area

29.522

Acid Dissociation Constant (pKa)

20.51

Base Dissociation Constant (pKb)

0.89

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

5.00

6996-0646 in Drug Discovery

Included in Screening Libraries

Protein Arginine Methyltransferases Library (27925 compounds)

MDM2-p53 interaction inhibitors Library (21687 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Cancer
Targets:
  • Others
Mechanism of action:
  • Epigenetic
  • PPI modulators

References: we are preparing a list of scientific research reports with 6996-0646 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6996-0646?
Check Price and Availability of 6996-0646, 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 6996-0646 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6996-0646
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6996-0646
  • 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 6996-0646 available by request