M596-0345 Screening compound: N-{[2-(3-methylphenyl)pyridin-3-yl]methyl}benzenesulfonamide

M596-0345 Screening compound: N-{[2-(3-methylphenyl)pyridin-3-yl]methyl}benzenesulfonamide
M596-0345 Screening compound: N-{[2-(3-methylphenyl)pyridin-3-yl]methyl}benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M596-0345
N-{[2-(3-methylphenyl)pyridin-3-yl]methyl}benzenesulfonamide

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

M596-0345

Molecular Formula

C19H18N2O2S (C19 H18 N2 O2 S)

Compound Name

N-{[2-(3-methylphenyl)pyridin-3-yl]methyl}benzenesulfonamide

IUPAC name

N-{[2-(3-methylphenyl)pyridin-3-yl]methyl}benzenesulfonamide

SMILES

Cc1cccc(-c2c(CNS(c3ccccc3)(=O)=O)cccn2)c1

InChI

InChI=1S/C19H18N2O2S/c1-15-7-5-8-16(13-15)19-17(9-6-12-20-19)14-21-24(22,23)18-10-3-2-4-11-18/h2-13,21H,14H2,1H3

InChI Key

NOYKCODMNLLFNK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27548609

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

338.43

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.839

Distribution Coefficient, logD

3.835

Water Solubility, LogSw

-3.84

Polar Surface Area

51.543

Acid Dissociation Constant (pKa)

9.93

Base Dissociation Constant (pKb)

5.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.50

M596-0345 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Glucocorticoid receptors Library (4806 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Akt-Targeted Library (14764 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Nervous system
  • Cardiovascular
Targets:
  • Nuclear receptors
  • Kinases
  • Ion Channels
Mechanism of action:
  • Receptor's ligands
  • PPI modulators

References: we are preparing a list of scientific research reports with M596-0345 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M596-0345?
Check Price and Availability of M596-0345, 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 M596-0345 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M596-0345
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M596-0345
  • 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 M596-0345 available by request