7706-0569 Screening compound: ethyl 2-(2,8-dimethyl-4-oxo-1,4-dihydroquinolin-1-yl)acetate

7706-0569 Screening compound: ethyl 2-(2,8-dimethyl-4-oxo-1,4-dihydroquinolin-1-yl)acetate
7706-0569 Screening compound: ethyl 2-(2,8-dimethyl-4-oxo-1,4-dihydroquinolin-1-yl)acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound 7706-0569
ethyl 2-(2,8-dimethyl-4-oxo-1,4-dihydroquinolin-1-yl)acetate

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

7706-0569

Molecular Formula

C15H17NO3 (C15 H17 NO3)

Compound Name

ethyl 2-(2,8-dimethyl-4-oxo-1,4-dihydroquinolin-1-yl)acetate

IUPAC name

ethyl 2-(28-dimethyl-4-oxo-14-dihydroquinolin-1-yl)acetate

SMILES

CCOC(CN(C(C)=C1)c(c(C)ccc2)c2C1=O)=O

InChI

InChI=1S/C15H17NO3/c1-4-19-14(18)9-16-11(3)8-13(17)12-7-5-6-10(2)15(12)16/h5-8H,4,9H2,1-3H3

InChI Key

MJEYESJLVCXAGP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03666612

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

259.3

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.696

Distribution Coefficient, logD

2.696

Water Solubility, LogSw

-3.04

Polar Surface Area

36.207

Acid Dissociation Constant (pKa)

24.59

Base Dissociation Constant (pKb)

-3.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

7706-0569 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiparasite Library (23996 compounds)

Soluble Diversity Library (15920 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 7706-0569 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7706-0569?
Check Price and Availability of 7706-0569, 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 7706-0569 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7706-0569
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7706-0569
  • 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 7706-0569 available by request