P636-0581 Screening compound: N-benzyl-2-{4-[1-(1-methyl-6-oxo-1,6-dihydropyridazin-4-yl)piperidine-4-carbonyl]piperazin-1-yl}acetamide

P636-0581 Screening compound: N-benzyl-2-{4-[1-(1-methyl-6-oxo-1,6-dihydropyridazin-4-yl)piperidine-4-carbonyl]piperazin-1-yl}acetamide
P636-0581 Screening compound: N-benzyl-2-{4-[1-(1-methyl-6-oxo-1,6-dihydropyridazin-4-yl)piperidine-4-carbonyl]piperazin-1-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P636-0581
N-benzyl-2-{4-[1-(1-methyl-6-oxo-1,6-dihydropyridazin-4-yl)piperidine-4-carbonyl]piperazin-1-yl}acetamide

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

P636-0581

Molecular Formula

C24H32N6O3 (C24 H32 N6 O3)

Compound Name

N-benzyl-2-{4-[1-(1-methyl-6-oxo-1,6-dihydropyridazin-4-yl)piperidine-4-carbonyl]piperazin-1-yl}acetamide

IUPAC name

N-benzyl-2-{4-[1-(1-methyl-6-oxo-16-dihydropyridazin-4-yl)piperidine-4-carbonyl]piperazin-1-yl}acetamide

SMILES

CN1N=CC(N(CC2)CCC2C(N2CCN(CC(NCc3ccccc3)=O)CC2)=O)=CC1=O

InChI

InChI=1S/C24H32N6O3/c1-27-23(32)15-21(17-26-27)29-9-7-20(8-10-29)24(33)30-13-11-28(12-14-30)18-22(31)25-16-19-5-3-2-4-6-19/h2-6,15,17,20H,7-14,16,18H2,1H3,(H,25,31)

InChI Key

ASTGCUKHCMKDED-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29014139

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

452.56

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

0.834

Distribution Coefficient, logD

0.525

Water Solubility, LogSw

-1.80

Polar Surface Area

77.104

Acid Dissociation Constant (pKa)

13.07

Base Dissociation Constant (pKb)

6.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

50.00

P636-0581 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with P636-0581 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P636-0581?
Check Price and Availability of P636-0581, 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 P636-0581 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P636-0581
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P636-0581
  • 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 P636-0581 available by request