K839-0090 Screening compound: N-[(2-chlorophenyl)(8-hydroxyquinolin-7-yl)methyl]butanamide

K839-0090 Screening compound: N-[(2-chlorophenyl)(8-hydroxyquinolin-7-yl)methyl]butanamide
K839-0090 Screening compound: N-[(2-chlorophenyl)(8-hydroxyquinolin-7-yl)methyl]butanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K839-0090
N-[(2-chlorophenyl)(8-hydroxyquinolin-7-yl)methyl]butanamide

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

K839-0090

Molecular Formula

C20H19ClN2O2 (C20 H19 ClN2 O2)

Compound Name

N-[(2-chlorophenyl)(8-hydroxyquinolin-7-yl)methyl]butanamide

IUPAC name

N-[(2-chlorophenyl)(8-hydroxyquinolin-7-yl)methyl]butanamide

SMILES

CCCC(NC(c(cccc1)c1Cl)c(ccc1cccnc11)c1O)=O

InChI

InChI=1S/C20H19ClN2O2/c1-2-6-17(24)23-19(14-8-3-4-9-16(14)21)15-11-10-13-7-5-12-22-18(13)20(15)25/h3-5,7-12,19,25H,2,6H2,1H3,(H,23,24)/t19-/m0/s1

InChI Key

OWOWQMUMYCQXBI-IBGZPJMESA-N

MDL Number (MFCD)

MFCD02045683

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

354.84

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.315

Distribution Coefficient, logD

4.313

Water Solubility, LogSw

-4.15

Polar Surface Area

48.803

Acid Dissociation Constant (pKa)

10.17

Base Dissociation Constant (pKb)

4.21

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

20.00

K839-0090 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiviral Annotated Library (21441 compounds)

Antiviral Library (67538 compounds)

CNS targets activity set (6557 compounds)

Chelators targeting matrix metalloproteinases library (8930 compounds)

Hsp90-Targeted Library (11355 compounds)

Human GPCR Annotated Library (5539 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 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
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Immune system
  • Nervous system
Targets:
  • Proteases
  • Ion Channels

References: we are preparing a list of scientific research reports with K839-0090 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K839-0090?
Check Price and Availability of K839-0090, 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 K839-0090 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K839-0090
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K839-0090
  • 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 K839-0090 available by request