L454-0531 Screening compound: N-[(2-chlorophenyl)methyl]-6-(3-fluorophenyl)pyridine-3-carboxamide

L454-0531 Screening compound: N-[(2-chlorophenyl)methyl]-6-(3-fluorophenyl)pyridine-3-carboxamide
L454-0531 Screening compound: N-[(2-chlorophenyl)methyl]-6-(3-fluorophenyl)pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound L454-0531
N-[(2-chlorophenyl)methyl]-6-(3-fluorophenyl)pyridine-3-carboxamide

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

L454-0531

Molecular Formula

C19H14ClFN2O (C19 H14 ClFN2 O)

Compound Name

N-[(2-chlorophenyl)methyl]-6-(3-fluorophenyl)pyridine-3-carboxamide

IUPAC name

N-[(2-chlorophenyl)methyl]-6-(3-fluorophenyl)pyridine-3-carboxamide

SMILES

O=C(c(cc1)cnc1-c1cc(F)ccc1)NCc(cccc1)c1Cl

InChI

InChI=1S/C19H14ClFN2O/c20-17-7-2-1-4-14(17)11-23-19(24)15-8-9-18(22-12-15)13-5-3-6-16(21)10-13/h1-10,12H,11H2,(H,23,24)

InChI Key

YWXXOEQDNOSCGT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27253478

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

340.78

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.673

Distribution Coefficient, logD

4.673

Water Solubility, LogSw

-5.01

Polar Surface Area

33.518

Acid Dissociation Constant (pKa)

11.44

Base Dissociation Constant (pKb)

4.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.30

L454-0531 in Drug Discovery

Included in Screening Libraries

C-Met Library (15277 compounds)

CNS BBB Library (22607 compounds)

CNS Targets (44014 compounds)

STING Agonist Library (5895 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with L454-0531 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L454-0531?
Check Price and Availability of L454-0531, 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 L454-0531 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L454-0531
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L454-0531
  • 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 L454-0531 available by request