K844-0854 Screening compound: N-[(3,4-dimethoxyphenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,2-dihydroquinoline-3-carboxamide

K844-0854 Screening compound: N-[(3,4-dimethoxyphenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,2-dihydroquinoline-3-carboxamide
K844-0854 Screening compound: N-[(3,4-dimethoxyphenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,2-dihydroquinoline-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound K844-0854
N-[(3,4-dimethoxyphenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,2-dihydroquinoline-3-carboxamide

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

K844-0854

Molecular Formula

C20H20N2O5 (C20 H20 N2 O5)

Compound Name

N-[(3,4-dimethoxyphenyl)methyl]-4-hydroxy-1-methyl-2-oxo-1,2-dihydroquinoline-3-carboxamide

IUPAC name

N-[(34-dimethoxyphenyl)methyl]-4-hydroxy-1-methyl-2-oxo-12-dihydroquinoline-3-carboxamide

SMILES

CN(c(cccc1)c1C(O)=C1C(NCc(cc2)cc(OC)c2OC)=O)C1=O

InChI

InChI=1S/C20H20N2O5/c1-22-14-7-5-4-6-13(14)18(23)17(20(22)25)19(24)21-11-12-8-9-15(26-2)16(10-12)27-3/h4-10,23H,11H2,1-3H3,(H,21,24)

InChI Key

SCXJDODDSWPGEL-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03043453

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

368.39

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.068

Distribution Coefficient, logD

-1.053

Water Solubility, LogSw

-2.39

Polar Surface Area

70.124

Acid Dissociation Constant (pKa)

5.28

Base Dissociation Constant (pKb)

-0.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

K844-0854 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

Dark Chemical Matter Library (18430 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
  • Pool

References: we are preparing a list of scientific research reports with K844-0854 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K844-0854?
Check Price and Availability of K844-0854, 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 K844-0854 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K844-0854
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K844-0854
  • 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 K844-0854 available by request