K839-0076 Screening compound: N-[(8-hydroxyquinolin-7-yl)(2-methoxyphenyl)methyl]pentanamide

K839-0076 Screening compound: N-[(8-hydroxyquinolin-7-yl)(2-methoxyphenyl)methyl]pentanamide
K839-0076 Screening compound: N-[(8-hydroxyquinolin-7-yl)(2-methoxyphenyl)methyl]pentanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K839-0076
N-[(8-hydroxyquinolin-7-yl)(2-methoxyphenyl)methyl]pentanamide

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

K839-0076

Molecular Formula

C22H24N2O3 (C22 H24 N2 O3)

Compound Name

N-[(8-hydroxyquinolin-7-yl)(2-methoxyphenyl)methyl]pentanamide

IUPAC name

N-[(8-hydroxyquinolin-7-yl)(2-methoxyphenyl)methyl]pentanamide

SMILES

CCCCC(NC(c(cccc1)c1OC)c(ccc1cccnc11)c1O)=O

InChI

InChI=1S/C22H24N2O3/c1-3-4-11-19(25)24-21(16-9-5-6-10-18(16)27-2)17-13-12-15-8-7-14-23-20(15)22(17)26/h5-10,12-14,21,26H,3-4,11H2,1-2H3,(H,24,25)/t21-/m0/s1

InChI Key

PMTOJOBSFYBPBL-NRFANRHFSA-N

MDL Number (MFCD)

MFCD02045689

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

364.44

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.202

Distribution Coefficient, logD

4.201

Water Solubility, LogSw

-3.84

Polar Surface Area

56.433

Acid Dissociation Constant (pKa)

10.17

Base Dissociation Constant (pKb)

4.21

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

27.30

K839-0076 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Hsp90-Targeted Library (11355 compounds)

Human GPCR Annotated Library (5539 compounds)

Nucleic Acid Ligands (8311 compounds)

Targeted Diversity Library (40567 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Cardiovascular
  • Cancer
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Nervous system
  • Hemic and lymphatic
  • Immune system
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with K839-0076 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K839-0076?
Check Price and Availability of K839-0076, 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 K839-0076 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K839-0076
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K839-0076
  • 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 K839-0076 available by request