0717-0939 Screening compound: 1-(4-chlorobenzenesulfonyl)-1H-1,3-benzodiazole

0717-0939 Screening compound: 1-(4-chlorobenzenesulfonyl)-1H-1,3-benzodiazole
0717-0939 Screening compound: 1-(4-chlorobenzenesulfonyl)-1H-1,3-benzodiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound 0717-0939
1-(4-chlorobenzenesulfonyl)-1H-1,3-benzodiazole

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

0717-0939

Molecular Formula

C13H9ClN2O2S (C13 H9 ClN2 O2 S)

Compound Name

1-(4-chlorobenzenesulfonyl)-1H-1,3-benzodiazole

IUPAC name

1-(4-chlorobenzenesulfonyl)-1H-13-benzodiazole

SMILES

O=S(c(cc1)ccc1Cl)(n1c(cccc2)c2nc1)=O

InChI

InChI=1S/C13H9ClN2O2S/c14-10-5-7-11(8-6-10)19(17,18)16-9-15-12-3-1-2-4-13(12)16/h1-9H

InChI Key

ILWBKMKLQSOCPN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00586324

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

292.75

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.117

Distribution Coefficient, logD

3.117

Water Solubility, LogSw

-3.37

Polar Surface Area

37.684

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

0.75

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0717-0939 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

Dark Chemical Matter Library (18430 compounds)

Fragments Library (11262 compounds)

STING Agonist Library (5895 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Cancer
  • Immune system
Mechanism of action:
  • Epigenetic
Agro:
  • Agro
Structure:
  • Pool
  • Fragments
Targets:
  • Others

References: we are preparing a list of scientific research reports with 0717-0939 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0717-0939?
Check Price and Availability of 0717-0939, 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 0717-0939 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0717-0939
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0717-0939
  • 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 0717-0939 available by request