J057-0747 Screening compound: 2-chloro-5-[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-N,N-dimethylbenzene-1-sulfonamide

J057-0747 Screening compound: 2-chloro-5-[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-N,N-dimethylbenzene-1-sulfonamide
J057-0747 Screening compound: 2-chloro-5-[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-N,N-dimethylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J057-0747
2-chloro-5-[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-N,N-dimethylbenzene-1-sulfonamide

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

J057-0747

Molecular Formula

C17H16ClN3O4S (C17 H16 ClN3 O4 S)

Compound Name

2-chloro-5-[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-N,N-dimethylbenzene-1-sulfonamide

IUPAC name

2-chloro-5-[5-(2-methoxyphenyl)-134-oxadiazol-2-yl]-NN-dimethylbenzene-1-sulfonamide

SMILES

CN(C)S(c(cc(cc1)-c2nnc(-c(cccc3)c3OC)o2)c1Cl)(=O)=O

InChI

InChI=1S/C17H16ClN3O4S/c1-21(2)26(22,23)15-10-11(8-9-13(15)18)16-19-20-17(25-16)12-6-4-5-7-14(12)24-3/h4-10H,1-3H3

InChI Key

LXYSSMZULKBOPX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27222983

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.85

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.788

Distribution Coefficient, logD

2.788

Water Solubility, LogSw

-3.72

Polar Surface Area

71.777

Acid Dissociation Constant (pKa)

31.06

Base Dissociation Constant (pKb)

-4.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

17.60

J057-0747 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anti-Inflammatory Library (24602 compounds)

Cardiovascular Library (22201 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Immune system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
  • PPI modulators

References: we are preparing a list of scientific research reports with J057-0747 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J057-0747?
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What is the minimum amount of J057-0747 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J057-0747
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J057-0747
  • 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 J057-0747 available by request