J057-1516 Screening compound: 4-{4-chloro-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzenesulfonyl}thiomorpholine

J057-1516 Screening compound: 4-{4-chloro-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzenesulfonyl}thiomorpholine
J057-1516 Screening compound: 4-{4-chloro-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzenesulfonyl}thiomorpholine alternative view

Chemical Structure Depiction of ChemDiv screening compound J057-1516
4-{4-chloro-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzenesulfonyl}thiomorpholine

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

J057-1516

Molecular Formula

C19H18ClN3O4S2 (C19 H18 ClN3 O4 S2)

Compound Name

4-{4-chloro-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzenesulfonyl}thiomorpholine

IUPAC name

4-{4-chloro-3-[5-(4-methoxyphenyl)-134-oxadiazol-2-yl]benzenesulfonyl}thiomorpholine

SMILES

COc(cc1)ccc1-c1nnc(-c(cc(cc2)S(N3CCSCC3)(=O)=O)c2Cl)o1

InChI

InChI=1S/C19H18ClN3O4S2/c1-26-14-4-2-13(3-5-14)18-21-22-19(27-18)16-12-15(6-7-17(16)20)29(24,25)23-8-10-28-11-9-23/h2-7,12H,8-11H2,1H3

InChI Key

CPZPACYSWIEXTD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27223127

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

451.95

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.748

Distribution Coefficient, logD

3.748

Water Solubility, LogSw

-4.36

Polar Surface Area

69.737

Acid Dissociation Constant (pKa)

28.41

Base Dissociation Constant (pKb)

-5.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

J057-1516 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with J057-1516 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J057-1516?
Check Price and Availability of J057-1516, 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 J057-1516 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J057-1516
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J057-1516
  • 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 J057-1516 available by request