8397-0166 Screening compound: ethyl 4-{[(8-hydroxyquinolin-7-yl)(pyridin-3-yl)methyl]amino}benzoate

8397-0166 Screening compound: ethyl 4-{[(8-hydroxyquinolin-7-yl)(pyridin-3-yl)methyl]amino}benzoate
8397-0166 Screening compound: ethyl 4-{[(8-hydroxyquinolin-7-yl)(pyridin-3-yl)methyl]amino}benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound 8397-0166
ethyl 4-{[(8-hydroxyquinolin-7-yl)(pyridin-3-yl)methyl]amino}benzoate

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

8397-0166

Molecular Formula

C24H21N3O3 (C24 H21 N3 O3)

Compound Name

ethyl 4-{[(8-hydroxyquinolin-7-yl)(pyridin-3-yl)methyl]amino}benzoate

IUPAC name

ethyl 4-{[(8-hydroxyquinolin-7-yl)(pyridin-3-yl)methyl]amino}benzoate

SMILES

CCOC(c(cc1)ccc1NC(c1cnccc1)c(ccc1cccnc11)c1O)=O

InChI

InChI=1S/C24H21N3O3/c1-2-30-24(29)17-7-10-19(11-8-17)27-21(18-6-3-13-25-15-18)20-12-9-16-5-4-14-26-22(16)23(20)28/h3-15,21,27-28H,2H2,1H3/t21-/m0/s1

InChI Key

RMGPQZGEQNZXMS-NRFANRHFSA-N

MDL Number (MFCD)

MFCD08823496

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

399.45

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.598

Distribution Coefficient, logD

4.590

Water Solubility, LogSw

-4.27

Polar Surface Area

64.837

Acid Dissociation Constant (pKa)

10.20

Base Dissociation Constant (pKb)

5.65

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

12.50

8397-0166 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Antiviral Library (67538 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

DGK Inhibitors Library (10558 compounds)

Targeted Diversity Library (40567 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Cardiovascular
  • Cancer
  • Digestive system
  • Hemic and lymphatic
  • Skin
  • Metabolic
  • Immune system
Agro:
  • Agro
Targets:
  • Proteases
  • Kinases

References: we are preparing a list of scientific research reports with 8397-0166 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8397-0166?
Check Price and Availability of 8397-0166, 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 8397-0166 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8397-0166
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8397-0166
  • 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 8397-0166 available by request