P801-0224 Screening compound: (4-methylpiperazino)[2-(3-phenylpiperazino)-4-pyridyl]methanone

P801-0224 Screening compound: (4-methylpiperazino)[2-(3-phenylpiperazino)-4-pyridyl]methanone
P801-0224 Screening compound: (4-methylpiperazino)[2-(3-phenylpiperazino)-4-pyridyl]methanone alternative view

Chemical Structure Depiction of ChemDiv screening compound P801-0224
(4-methylpiperazino)[2-(3-phenylpiperazino)-4-pyridyl]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

P801-0224

Molecular Formula

C21H27N5O (C21 H27 N5 O)

Compound Name

(4-methylpiperazino)[2-(3-phenylpiperazino)-4-pyridyl]methanone

IUPAC name

1-[4-(4-methylpiperazine-1-carbonyl)pyridin-2-yl]-3-phenylpiperazine

SMILES

CN(CC1)CCN1C(c1cc(N2CC(c3ccccc3)NCC2)ncc1)=O

InChI

InChI=1S/C21H27N5O/c1-24-11-13-25(14-12-24)21(27)18-7-8-23-20(15-18)26-10-9-22-19(16-26)17-5-3-2-4-6-17/h2-8,15,19,22H,9-14,16H2,1H3/t19-/m0/s1

InChI Key

HVLKKDNDIJETCJ-IBGZPJMESA-N

MDL Number (MFCD)

MFCD29025172

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

365.48

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.052

Distribution Coefficient, logD

0.504

Water Solubility, LogSw

-1.87

Polar Surface Area

44.101

Acid Dissociation Constant (pKa)

23.51

Base Dissociation Constant (pKb)

7.80

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

42.86

P801-0224 in Drug Discovery

Included in Screening Libraries

GPCR Targeted Library (31838 compounds)

Neurotransmitter Transporter Inhibitors Library (11024 compounds)

Protein-Protein Interaction Library (218420 compounds)

Soluble Diversity Library (15920 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
  • Nervous system
Targets:
  • GPCR
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with P801-0224 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P801-0224?
Check Price and Availability of P801-0224, 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 P801-0224 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P801-0224
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P801-0224
  • 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 P801-0224 available by request