4314-0333 Screening compound: 2-fluoro-N-[(pyridin-3-yl)methyl]benzamide

4314-0333 Screening compound: 2-fluoro-N-[(pyridin-3-yl)methyl]benzamide
4314-0333 Screening compound: 2-fluoro-N-[(pyridin-3-yl)methyl]benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4314-0333
2-fluoro-N-[(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

4314-0333

Molecular Formula

C13H11FN2O (C13 H11 FN2 O)

Compound Name

2-fluoro-N-[(pyridin-3-yl)methyl]benzamide

IUPAC name

2-fluoro-N-[(pyridin-3-yl)methyl]benzamide

SMILES

O=C(c(cccc1)c1F)NCc1cnccc1

InChI

InChI=1S/C13H11FN2O/c14-12-6-2-1-5-11(12)13(17)16-9-10-4-3-7-15-8-10/h1-8H,9H2,(H,16,17)

InChI Key

FNXBZFPQWHXXMX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00495375

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

230.24

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

1.740

Distribution Coefficient, logD

1.740

Water Solubility, LogSw

-1.85

Polar Surface Area

34.170

Acid Dissociation Constant (pKa)

11.55

Base Dissociation Constant (pKb)

3.76

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.70

4314-0333 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Fragments Library (11262 compounds)

STING Agonist Library (5895 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cancer
  • Immune system
  • Nervous system
  • Cardiovascular
Structure:
  • Fragments
Targets:
  • Others
  • Ion Channels

References: we are preparing a list of scientific research reports with 4314-0333 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4314-0333?
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What is the minimum amount of 4314-0333 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4314-0333
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4314-0333
  • 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 4314-0333 available by request