0856-0009 Screening compound: 3-chloro-N~2~-(1,3-thiazol-2-yl)-1-benzothiophene-2-carboxamide

0856-0009 Screening compound: 3-chloro-N~2~-(1,3-thiazol-2-yl)-1-benzothiophene-2-carboxamide
0856-0009 Screening compound: 3-chloro-N~2~-(1,3-thiazol-2-yl)-1-benzothiophene-2-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 0856-0009
3-chloro-N~2~-(1,3-thiazol-2-yl)-1-benzothiophene-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

0856-0009

Molecular Formula

C12H7ClN2OS2 (C12 H7 ClN2 OS2)

Compound Name

3-chloro-N~2~-(1,3-thiazol-2-yl)-1-benzothiophene-2-carboxamide

IUPAC name

3-chloro-N-(13-thiazol-2-yl)-1-benzothiophene-2-carboxamide

SMILES

O=C(c(sc1c2cccc1)c2Cl)Nc1nccs1

InChI

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

InChI Key

LJQWRJURTZQIGQ-UHFFFAOYSA-N

MDL Number (MFCD)

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

3.937

Distribution Coefficient, logD

3.904

Water Solubility, LogSw

-4.52

Polar Surface Area

34.555

Acid Dissociation Constant (pKa)

8.50

Base Dissociation Constant (pKb)

0.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

0856-0009 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 0856-0009 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0856-0009?
Check Price and Availability of 0856-0009, 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 0856-0009 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0856-0009
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0856-0009
  • 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 0856-0009 available by request