6049-1553 Screening compound: 2-(5-ethyl-2-thienyl)-4-quinolinecarboxylic acid

6049-1553 Screening compound: 2-(5-ethyl-2-thienyl)-4-quinolinecarboxylic acid
6049-1553 Screening compound: 2-(5-ethyl-2-thienyl)-4-quinolinecarboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 6049-1553
2-(5-ethyl-2-thienyl)-4-quinolinecarboxylic 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

6049-1553

Molecular Formula

C16H13NO2S (C16 H13 NO2 S)

Compound Name

2-(5-ethyl-2-thienyl)-4-quinolinecarboxylic acid

IUPAC name

2-(5-ethylthiophen-2-yl)quinoline-4-carboxylic acid

SMILES

CCc1ccc(-c2nc3ccccc3c(C(O)=O)c2)s1

InChI

InChI=1S/C16H13NO2S/c1-2-10-7-8-15(20-10)14-9-12(16(18)19)11-5-3-4-6-13(11)17-14/h3-9H,2H2,1H3,(H,18,19)

InChI Key

XXVQLZUJMHDGQT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01471526

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

283.35

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.966

Distribution Coefficient, logD

0.686

Water Solubility, LogSw

-4.51

Polar Surface Area

37.724

Acid Dissociation Constant (pKa)

3.71

Base Dissociation Constant (pKb)

2.38

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

12.50

6049-1553 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Annotated Library (21441 compounds)

Antiviral Library (67538 compounds)

CNS targets activity set (6557 compounds)

Human Receptors Annotated Library (5376 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 6049-1553 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 6049-1553?
Check Price and Availability of 6049-1553, 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 6049-1553 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 6049-1553
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 6049-1553
  • 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 6049-1553 available by request