M596-0003 Screening compound: N-{[2-(4-methoxyphenyl)-4,6-dimethylpyridin-3-yl]methyl}benzenesulfonamide

M596-0003 Screening compound: N-{[2-(4-methoxyphenyl)-4,6-dimethylpyridin-3-yl]methyl}benzenesulfonamide
M596-0003 Screening compound: N-{[2-(4-methoxyphenyl)-4,6-dimethylpyridin-3-yl]methyl}benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M596-0003
N-{[2-(4-methoxyphenyl)-4,6-dimethylpyridin-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

M596-0003

Molecular Formula

C21H22N2O3S (C21 H22 N2 O3 S)

Compound Name

N-{[2-(4-methoxyphenyl)-4,6-dimethylpyridin-3-yl]methyl}benzenesulfonamide

IUPAC name

N-{[2-(4-methoxyphenyl)-46-dimethylpyridin-3-yl]methyl}benzenesulfonamide

SMILES

Cc1cc(C)nc(-c(cc2)ccc2OC)c1CNS(c1ccccc1)(=O)=O

InChI

InChI=1S/C21H22N2O3S/c1-15-13-16(2)23-21(17-9-11-18(26-3)12-10-17)20(15)14-22-27(24,25)19-7-5-4-6-8-19/h4-13,22H,14H2,1-3H3

InChI Key

NZYUYXFGANPRDT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27548573

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

382.48

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.173

Distribution Coefficient, logD

4.146

Water Solubility, LogSw

-4.32

Polar Surface Area

58.462

Acid Dissociation Constant (pKa)

9.61

Base Dissociation Constant (pKb)

6.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

19.00

M596-0003 in Drug Discovery

Included in Screening Libraries

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

Mechanism of action:
  • PPI modulators
Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Nervous system
  • Cardiovascular
Targets:
  • Kinases
  • Ion Channels

References: we are preparing a list of scientific research reports with M596-0003 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M596-0003?
Check Price and Availability of M596-0003, 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 M596-0003 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M596-0003
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M596-0003
  • 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 M596-0003 available by request