S055-0696 Screening compound: N-[(2-ethoxypyridin-3-yl)methyl]-3-fluoro-4-methoxybenzamide

S055-0696 Screening compound: N-[(2-ethoxypyridin-3-yl)methyl]-3-fluoro-4-methoxybenzamide
S055-0696 Screening compound: N-[(2-ethoxypyridin-3-yl)methyl]-3-fluoro-4-methoxybenzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound S055-0696
N-[(2-ethoxypyridin-3-yl)methyl]-3-fluoro-4-methoxybenzamide

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

S055-0696

Molecular Formula

C16H17FN2O3 (C16 H17 FN2 O3)

Compound Name

N-[(2-ethoxypyridin-3-yl)methyl]-3-fluoro-4-methoxybenzamide

IUPAC name

N-[(2-ethoxypyridin-3-yl)methyl]-3-fluoro-4-methoxybenzamide

SMILES

CCOc1c(CNC(c(cc2)cc(F)c2OC)=O)cccn1

InChI

InChI=1S/C16H17FN2O3/c1-3-22-16-12(5-4-8-18-16)10-19-15(20)11-6-7-14(21-2)13(17)9-11/h4-9H,3,10H2,1-2H3,(H,19,20)

InChI Key

MTJUTOWKFPFKFT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29030720

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

304.32

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

3.010

Distribution Coefficient, logD

3.010

Water Solubility, LogSw

-3.30

Polar Surface Area

49.211

Acid Dissociation Constant (pKa)

11.90

Base Dissociation Constant (pKb)

1.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

S055-0696 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

Antibacterial Compounds Library (13827 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Endocrine
  • Infections
  • Immune system
  • animal
Targets:
  • Kinases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with S055-0696 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S055-0696?
Check Price and Availability of S055-0696, 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 S055-0696 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S055-0696
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S055-0696
  • 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 S055-0696 available by request