F428-0540 Screening compound: N-[(4-methylphenyl)methyl]-1-[6-(piperidin-1-yl)pyridazin-3-yl]piperidine-4-carboxamide

F428-0540 Screening compound: N-[(4-methylphenyl)methyl]-1-[6-(piperidin-1-yl)pyridazin-3-yl]piperidine-4-carboxamide
F428-0540 Screening compound: N-[(4-methylphenyl)methyl]-1-[6-(piperidin-1-yl)pyridazin-3-yl]piperidine-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F428-0540
N-[(4-methylphenyl)methyl]-1-[6-(piperidin-1-yl)pyridazin-3-yl]piperidine-4-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

F428-0540

Molecular Formula

C23H31N5O (C23 H31 N5 O)

Compound Name

N-[(4-methylphenyl)methyl]-1-[6-(piperidin-1-yl)pyridazin-3-yl]piperidine-4-carboxamide

IUPAC name

N-[(4-methylphenyl)methyl]-1-[6-(piperidin-1-yl)pyridazin-3-yl]piperidine-4-carboxamide

SMILES

Cc1ccc(CNC(C(CC2)CCN2c(cc2)nnc2N2CCCCC2)=O)cc1

InChI

InChI=1S/C23H31N5O/c1-18-5-7-19(8-6-18)17-24-23(29)20-11-15-28(16-12-20)22-10-9-21(25-26-22)27-13-3-2-4-14-27/h5-10,20H,2-4,11-17H2,1H3,(H,24,29)

InChI Key

GODDYRKMGAVUIW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27127523

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

393.53

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.660

Distribution Coefficient, logD

3.657

Water Solubility, LogSw

-3.50

Polar Surface Area

52.227

Acid Dissociation Constant (pKa)

12.56

Base Dissociation Constant (pKb)

7.17

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

52.20

F428-0540 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

CORONAVIRUS Library (20774 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Cyclic compounds
  • Mimetics
Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases
Mechanism of action:
  • PPI modulators
  • PPI modulators

References: we are preparing a list of scientific research reports with F428-0540 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F428-0540?
Check Price and Availability of F428-0540, 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 F428-0540 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F428-0540
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F428-0540
  • 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 F428-0540 available by request