8016-4675 Screening compound: N-(4-chloro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide

8016-4675 Screening compound: N-(4-chloro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide
8016-4675 Screening compound: N-(4-chloro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8016-4675
N-(4-chloro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide

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

8016-4675

Molecular Formula

C12H7ClN2OS2 (C12 H7 ClN2 OS2)

Compound Name

N-(4-chloro-1,3-benzothiazol-2-yl)thiophene-2-carboxamide

IUPAC name

N-(4-chloro-13-benzothiazol-2-yl)thiophene-2-carboxamide

SMILES

O=C(c1cccs1)Nc(sc1ccc2)nc1c2Cl

InChI

InChI=1S/C12H7ClN2OS2/c13-7-3-1-4-8-10(7)14-12(18-8)15-11(16)9-5-2-6-17-9/h1-6H,(H,14,15,16)

InChI Key

IEIHJBXEJPSAGE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05238578

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

294.79

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.175

Distribution Coefficient, logD

4.161

Water Solubility, LogSw

-4.54

Polar Surface Area

34.880

Acid Dissociation Constant (pKa)

8.88

Base Dissociation Constant (pKb)

-1.29

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8016-4675 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Antiparasite Library (23996 compounds)

Antiviral Annotated Library (21441 compounds)

Human Proteases Annotated Library (2868 compounds)

Human Receptors Annotated Library (5376 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Kinases
Agro:
  • Agro
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8016-4675 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8016-4675?
Check Price and Availability of 8016-4675, 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 8016-4675 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8016-4675
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8016-4675
  • 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 8016-4675 available by request