5069-0243 Screening compound: 3-(4-methylbenzoyl)-1,3-thiazolidine-2-thione

5069-0243 Screening compound: 3-(4-methylbenzoyl)-1,3-thiazolidine-2-thione
5069-0243 Screening compound: 3-(4-methylbenzoyl)-1,3-thiazolidine-2-thione alternative view

Chemical Structure Depiction of ChemDiv screening compound 5069-0243
3-(4-methylbenzoyl)-1,3-thiazolidine-2-thione

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

5069-0243

Molecular Formula

C11H11NOS2 (C11 H11 NOS2)

Compound Name

3-(4-methylbenzoyl)-1,3-thiazolidine-2-thione

IUPAC name

3-(4-methylbenzoyl)-13-thiazolidine-2-thione

SMILES

Cc(cc1)ccc1C(N(CCS1)C1=S)=O

InChI

InChI=1S/C11H11NOS2/c1-8-2-4-9(5-3-8)10(13)12-6-7-15-11(12)14/h2-5H,6-7H2,1H3

InChI Key

KXWQVHWLUHGXAV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03545921

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

237.35

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

2.401

Distribution Coefficient, logD

2.401

Water Solubility, LogSw

-2.49

Polar Surface Area

16.924

Acid Dissociation Constant (pKa)

28.80

Base Dissociation Constant (pKb)

-8.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

5069-0243 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 5069-0243 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5069-0243?
Check Price and Availability of 5069-0243, 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 5069-0243 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5069-0243
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5069-0243
  • 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 5069-0243 available by request