S055-0128 Screening compound: 3-(3-methoxyphenyl)-N-[(2-methoxypyridin-3-yl)methyl]propanamide

S055-0128 Screening compound: 3-(3-methoxyphenyl)-N-[(2-methoxypyridin-3-yl)methyl]propanamide
S055-0128 Screening compound: 3-(3-methoxyphenyl)-N-[(2-methoxypyridin-3-yl)methyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S055-0128
3-(3-methoxyphenyl)-N-[(2-methoxypyridin-3-yl)methyl]propanamide

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

S055-0128

Molecular Formula

C17H20N2O3 (C17 H20 N2 O3)

Compound Name

3-(3-methoxyphenyl)-N-[(2-methoxypyridin-3-yl)methyl]propanamide

IUPAC name

3-(3-methoxyphenyl)-N-[(2-methoxypyridin-3-yl)methyl]propanamide

SMILES

COc1cccc(CCC(NCc(cccn2)c2OC)=O)c1

InChI

InChI=1S/C17H20N2O3/c1-21-15-7-3-5-13(11-15)8-9-16(20)19-12-14-6-4-10-18-17(14)22-2/h3-7,10-11H,8-9,12H2,1-2H3,(H,19,20)

InChI Key

NLDVHOGTUCRSRY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29030448

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

300.36

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.880

Distribution Coefficient, logD

2.880

Water Solubility, LogSw

-3.30

Polar Surface Area

49.331

Acid Dissociation Constant (pKa)

13.40

Base Dissociation Constant (pKb)

2.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

S055-0128 in Drug Discovery

Included in Screening Libraries

SmartTM Library (51161 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with S055-0128 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S055-0128?
Check Price and Availability of S055-0128, 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 S055-0128 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S055-0128
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S055-0128
  • 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 S055-0128 available by request