J057-1530 Screening compound: 1-{4-chloro-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzenesulfonyl}-4-methylpiperazine

J057-1530 Screening compound: 1-{4-chloro-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzenesulfonyl}-4-methylpiperazine
J057-1530 Screening compound: 1-{4-chloro-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzenesulfonyl}-4-methylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound J057-1530
1-{4-chloro-3-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]benzenesulfonyl}-4-methylpiperazine

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

J057-1530

Molecular Formula

C20H21ClN4O4S (C20 H21 ClN4 O4 S)

Compound Name

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

IUPAC name

1-{4-chloro-3-[5-(4-methoxyphenyl)-134-oxadiazol-2-yl]benzenesulfonyl}-4-methylpiperazine

SMILES

CN(CC1)CCN1S(c(cc1)cc(-c2nnc(-c(cc3)ccc3OC)o2)c1Cl)(=O)=O

InChI

InChI=1S/C20H21ClN4O4S/c1-24-9-11-25(12-10-24)30(26,27)16-7-8-18(21)17(13-16)20-23-22-19(29-20)14-3-5-15(28-2)6-4-14/h3-8,13H,9-12H2,1-2H3

InChI Key

YEQTWRPTGALPCY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27223129

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

448.93

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.057

Distribution Coefficient, logD

2.994

Water Solubility, LogSw

-3.72

Polar Surface Area

73.214

Acid Dissociation Constant (pKa)

28.13

Base Dissociation Constant (pKb)

6.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

30.00

J057-1530 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

CNS Targets (44014 compounds)

Protein-Protein Interaction Library (218420 compounds)

Regenerative Medicine Focused Library (23016 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Nervous system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with J057-1530 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J057-1530?
Check Price and Availability of J057-1530, 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 J057-1530 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J057-1530
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J057-1530
  • 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 J057-1530 available by request