1682-6709 Screening compound: N-[(5E)-4-oxo-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]benzenesulfonamide

1682-6709 Screening compound: N-[(5E)-4-oxo-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]benzenesulfonamide
1682-6709 Screening compound: N-[(5E)-4-oxo-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 1682-6709
N-[(5E)-4-oxo-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]benzenesulfonamide

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

1682-6709

Molecular Formula

C16H12N2O3S3 (C16 H12 N2 O3 S3)

Compound Name

N-[(5E)-4-oxo-5-(phenylmethylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]benzenesulfonamide

IUPAC name

N-[(5E)-4-oxo-5-(phenylmethylidene)-2-sulfanylidene-13-thiazolidin-3-yl]benzenesulfonamide

SMILES

O=C(/C(/SC1=S)=C\c2ccccc2)N1NS(c1ccccc1)(=O)=O

InChI

InChI=1S/C16H12N2O3S3/c19-15-14(11-12-7-3-1-4-8-12)23-16(22)18(15)17-24(20,21)13-9-5-2-6-10-13/h1-11,17H

InChI Key

YMWXQEPXNNIXDH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00704591

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

376.48

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.956

Distribution Coefficient, logD

2.955

Water Solubility, LogSw

-3.51

Polar Surface Area

58.530

Acid Dissociation Constant (pKa)

10.18

Base Dissociation Constant (pKb)

-5.72

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

1682-6709 in Drug Discovery

Included in Screening Libraries

DGK Inhibitors Library (10558 compounds)

Frequent Hitters Library (7624 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Targets:
  • Kinases
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 1682-6709 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 1682-6709?
Check Price and Availability of 1682-6709, 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 1682-6709 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 1682-6709
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 1682-6709
  • 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 1682-6709 available by request