8018-8653 Screening compound: 4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylic acid

8018-8653 Screening compound: 4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylic acid
8018-8653 Screening compound: 4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 8018-8653
4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylic acid

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

8018-8653

Molecular Formula

C8H9NO2S (C8 H9 NO2 S)

Compound Name

4H,5H,6H,7H-thieno[2,3-c]pyridine-3-carboxylic acid

IUPAC name

4H5H6H7H-thieno[23-c]pyridine-3-carboxylic acid

SMILES

OC(c1csc2c1CCNC2)=O

InChI

InChI=1S/C8H9NO2S/c10-8(11)6-4-12-7-3-9-2-1-5(6)7/h4,9H,1-3H2,(H,10,11)

InChI Key

JVRYZXPKMOJBQO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08273498

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

183.23

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

0.938

Distribution Coefficient, logD

-1.110

Water Solubility, LogSw

-1.72

Polar Surface Area

41.477

Acid Dissociation Constant (pKa)

5.44

Base Dissociation Constant (pKb)

8.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

37.50

8018-8653 in Drug Discovery

Included in Screening Libraries

3D-Fragment Library (4274 compounds)

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

GABA Library (7115 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Fragments
Therapeutical areas:
  • Eye
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • GPCR
  • Ion Channels
  • Phosphatases
  • Phosphatases
Mechanism of action:
  • Receptor's ligands
  • Epigenetic
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8018-8653 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8018-8653?
Check Price and Availability of 8018-8653, 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 8018-8653 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8018-8653
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8018-8653
  • 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 8018-8653 available by request