J057-1069 Screening compound: 1-[4-chloro-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzenesulfonyl]-4-phenylpiperazine

J057-1069 Screening compound: 1-[4-chloro-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzenesulfonyl]-4-phenylpiperazine
J057-1069 Screening compound: 1-[4-chloro-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzenesulfonyl]-4-phenylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound J057-1069
1-[4-chloro-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzenesulfonyl]-4-phenylpiperazine

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

J057-1069

Molecular Formula

C24H21ClN4O3S (C24 H21 ClN4 O3 S)

Compound Name

1-[4-chloro-3-(5-phenyl-1,3,4-oxadiazol-2-yl)benzenesulfonyl]-4-phenylpiperazine

IUPAC name

1-[4-chloro-3-(5-phenyl-134-oxadiazol-2-yl)benzenesulfonyl]-4-phenylpiperazine

SMILES

O=S(c(cc1)cc(-c2nnc(-c3ccccc3)o2)c1Cl)(N(CC1)CCN1c1ccccc1)=O

InChI

InChI=1S/C24H21ClN4O3S/c25-22-12-11-20(17-21(22)24-27-26-23(32-24)18-7-3-1-4-8-18)33(30,31)29-15-13-28(14-16-29)19-9-5-2-6-10-19/h1-12,17H,13-16H2

InChI Key

DVOOUIVGQOCSIG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27223045

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

480.97

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.787

Distribution Coefficient, logD

4.787

Water Solubility, LogSw

-5.05

Polar Surface Area

65.454

Acid Dissociation Constant (pKa)

27.94

Base Dissociation Constant (pKb)

2.22

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

J057-1069 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

KRAS-Targeted Library (16000 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with J057-1069 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J057-1069?
Check Price and Availability of J057-1069, 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 J057-1069 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J057-1069
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J057-1069
  • 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 J057-1069 available by request