2595-1123 Screening compound: 8-ethyl-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

2595-1123 Screening compound: 8-ethyl-4-oxo-1,4-dihydroquinoline-3-carboxylic acid
2595-1123 Screening compound: 8-ethyl-4-oxo-1,4-dihydroquinoline-3-carboxylic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound 2595-1123
8-ethyl-4-oxo-1,4-dihydroquinoline-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

2595-1123

Molecular Formula

C12H11NO3 (C12 H11 NO3)

Compound Name

8-ethyl-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

IUPAC name

8-ethyl-4-oxo-14-dihydroquinoline-3-carboxylic acid

SMILES

CCc1cccc2c1NC=C(C(O)=O)C2=O

InChI

InChI=1S/C12H11NO3/c1-2-7-4-3-5-8-10(7)13-6-9(11(8)14)12(15)16/h3-6H,2H2,1H3,(H,13,14)(H,15,16)

InChI Key

HYXADUGUMNZZHQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01909613

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

217.22

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

0.959

Distribution Coefficient, logD

-1.718

Water Solubility, LogSw

-2.39

Polar Surface Area

50.514

Acid Dissociation Constant (pKa)

4.72

Base Dissociation Constant (pKb)

-2.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.67

2595-1123 in Drug Discovery

Included in Screening Libraries

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 2595-1123 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2595-1123?
Check Price and Availability of 2595-1123, 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 2595-1123 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2595-1123
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2595-1123
  • 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 2595-1123 available by request