8008-5748 Screening compound: N-(6-methanesulfonyl-1,3-benzothiazol-2-yl)-3-methylbenzamide

8008-5748 Screening compound: N-(6-methanesulfonyl-1,3-benzothiazol-2-yl)-3-methylbenzamide
8008-5748 Screening compound: N-(6-methanesulfonyl-1,3-benzothiazol-2-yl)-3-methylbenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-5748
N-(6-methanesulfonyl-1,3-benzothiazol-2-yl)-3-methylbenzamide

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

8008-5748

Molecular Formula

C16H14N2O3S2 (C16 H14 N2 O3 S2)

Compound Name

N-(6-methanesulfonyl-1,3-benzothiazol-2-yl)-3-methylbenzamide

IUPAC name

N-(6-methanesulfonyl-13-benzothiazol-2-yl)-3-methylbenzamide

SMILES

Cc1cccc(C(Nc2nc(ccc(S(C)(=O)=O)c3)c3s2)=O)c1

InChI

InChI=1S/C16H14N2O3S2/c1-10-4-3-5-11(8-10)15(19)18-16-17-13-7-6-12(23(2,20)21)9-14(13)22-16/h3-9H,1-2H3,(H,17,18,19)

InChI Key

SFEHZNOWCXYJQP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01116274

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.43

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.947

Distribution Coefficient, logD

2.929

Water Solubility, LogSw

-3.44

Polar Surface Area

62.840

Acid Dissociation Constant (pKa)

8.78

Base Dissociation Constant (pKb)

-1.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

8008-5748 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Angiogenesis library (14822 compounds)

Anti-Aging Library (44940 compounds)

Antiviral Annotated Library (21441 compounds)

C-Met Library (15277 compounds)

Human Receptors Annotated Library (5376 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Type II Kinase Inhibitors Library (6956 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Cancer
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Digestive system
  • Hemic and lymphatic
  • Endocrine
Targets:
  • Kinases
  • Kinases
  • Proteases
  • Kinases
Mechanism of action:
  • Epigenetic
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8008-5748 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-5748?
Check Price and Availability of 8008-5748, 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 8008-5748 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-5748
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-5748
  • 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 8008-5748 available by request