L456-0044 Screening compound: [4-(3-methoxyphenyl)piperazino][1-(4-pyridyl)-3-piperidyl]methanone

L456-0044 Screening compound: [4-(3-methoxyphenyl)piperazino][1-(4-pyridyl)-3-piperidyl]methanone
L456-0044 Screening compound: [4-(3-methoxyphenyl)piperazino][1-(4-pyridyl)-3-piperidyl]methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound L456-0044
[4-(3-methoxyphenyl)piperazino][1-(4-pyridyl)-3-piperidyl]methanone

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

L456-0044

Molecular Formula

C22H28N4O2 (C22 H28 N4 O2)

Compound Name

[4-(3-methoxyphenyl)piperazino][1-(4-pyridyl)-3-piperidyl]methanone

IUPAC name

1-(3-methoxyphenyl)-4-[1-(pyridin-4-yl)piperidine-3-carbonyl]piperazine

SMILES

COc1cccc(N(CC2)CCN2C(C(CCC2)CN2c2ccncc2)=O)c1

InChI

InChI=1S/C22H28N4O2/c1-28-21-6-2-5-20(16-21)24-12-14-25(15-13-24)22(27)18-4-3-11-26(17-18)19-7-9-23-10-8-19/h2,5-10,16,18H,3-4,11-15,17H2,1H3/t18-/m0/s1

InChI Key

GDVZMNROUOQIRD-SFHVURJKSA-N

MDL Number (MFCD)

MFCD15127889

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.49

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.566

Distribution Coefficient, logD

1.961

Water Solubility, LogSw

-2.40

Polar Surface Area

40.505

Acid Dissociation Constant (pKa)

22.51

Base Dissociation Constant (pKb)

7.88

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

45.46

L456-0044 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • GPCR
  • Proteases
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with L456-0044 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound L456-0044?
Check Price and Availability of L456-0044, 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 L456-0044 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for L456-0044
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for L456-0044
  • 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 L456-0044 available by request