M594-0542 Screening compound: 4-methoxy-N-{[2-(4-methoxyphenyl)pyridin-3-yl]methyl}benzamide

M594-0542 Screening compound: 4-methoxy-N-{[2-(4-methoxyphenyl)pyridin-3-yl]methyl}benzamide
M594-0542 Screening compound: 4-methoxy-N-{[2-(4-methoxyphenyl)pyridin-3-yl]methyl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M594-0542
4-methoxy-N-{[2-(4-methoxyphenyl)pyridin-3-yl]methyl}benzamide

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

M594-0542

Molecular Formula

C21H20N2O3 (C21 H20 N2 O3)

Compound Name

4-methoxy-N-{[2-(4-methoxyphenyl)pyridin-3-yl]methyl}benzamide

IUPAC name

4-methoxy-N-{[2-(4-methoxyphenyl)pyridin-3-yl]methyl}benzamide

SMILES

COc(cc1)ccc1C(NCc1c(-c(cc2)ccc2OC)nccc1)=O

InChI

InChI=1S/C21H20N2O3/c1-25-18-9-5-15(6-10-18)20-17(4-3-13-22-20)14-23-21(24)16-7-11-19(26-2)12-8-16/h3-13H,14H2,1-2H3,(H,23,24)

InChI Key

LDXFTOGUUGAMOC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27548417

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

348.4

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.377

Distribution Coefficient, logD

3.377

Water Solubility, LogSw

-3.33

Polar Surface Area

49.286

Acid Dissociation Constant (pKa)

11.50

Base Dissociation Constant (pKb)

4.20

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

M594-0542 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Therapeutical areas:
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
  • Nervous system
  • Nervous system
  • Cardiovascular
Targets:
  • Proteases
  • Ion Channels
  • Ion Channels

References: we are preparing a list of scientific research reports with M594-0542 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M594-0542?
Check Price and Availability of M594-0542, 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 M594-0542 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M594-0542
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M594-0542
  • 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 M594-0542 available by request