R049-0069 Screening compound: 1,3-benzothiazole-2-thiol

R049-0069 Screening compound: 1,3-benzothiazole-2-thiol
R049-0069 Screening compound: 1,3-benzothiazole-2-thiol alternative view

Chemical Structure Depiction of ChemDiv screening compound R049-0069
1,3-benzothiazole-2-thiol

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

R049-0069

Molecular Formula

C7H5NS2 (C7 H5 NS2)

Compound Name

1,3-benzothiazole-2-thiol

IUPAC name

13-benzothiazole-2-thiol

SMILES

Sc1nc(cccc2)c2s1

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

167.26

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

0.00

Number of Nitrogen and Oxygen Atoms

1

Partition Coefficient, logP

2.606

Distribution Coefficient, logD

2.605

Water Solubility, LogSw

-2.95

Polar Surface Area

8.758

Acid Dissociation Constant (pKa)

10.33

Base Dissociation Constant (pKb)

0.50

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

R049-0069 in Drug Discovery

Included in Screening Libraries

Chelators targeting matrix metalloproteinases library (8930 compounds)

Human Receptors Annotated Library (5376 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
Targets:
  • Proteases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with R049-0069 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound R049-0069?
Check Price and Availability of R049-0069, 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 R049-0069 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for R049-0069
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for R049-0069
  • 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 R049-0069 available by request