K906-0131 Screening compound: 2-oxo-2H-1,3-benzoxathiol-6-yl thiophene-2-carboxylate

K906-0131 Screening compound: 2-oxo-2H-1,3-benzoxathiol-6-yl thiophene-2-carboxylate
K906-0131 Screening compound: 2-oxo-2H-1,3-benzoxathiol-6-yl thiophene-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound K906-0131
2-oxo-2H-1,3-benzoxathiol-6-yl thiophene-2-carboxylate

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

K906-0131

Molecular Formula

C12H6O4S2 (C12 H6 O4 S2)

Compound Name

2-oxo-2H-1,3-benzoxathiol-6-yl thiophene-2-carboxylate

IUPAC name

n/a

SMILES

O=C(c1cccs1)Oc(cc1)cc(O2)c1SC2=O

InChI

InChI=1S/C12H6O4S2/c13-11(10-2-1-5-17-10)15-7-3-4-9-8(6-7)16-12(14)18-9/h1-6H

InChI Key

TVIYBOLEXWXBCY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00265543

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

278.31

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.948

Distribution Coefficient, logD

2.948

Water Solubility, LogSw

-3.36

Polar Surface Area

43.707

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

K906-0131 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
  • Epigenetic

References: we are preparing a list of scientific research reports with K906-0131 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K906-0131?
Check Price and Availability of K906-0131, 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 K906-0131 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K906-0131
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K906-0131
  • 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 K906-0131 available by request