T424-0808 Screening compound: 1-(1-benzyl-6-oxo-1,6-dihydropyridazin-4-yl)-N-[(pyrazin-2-yl)methyl]piperidine-3-carboxamide

T424-0808 Screening compound: 1-(1-benzyl-6-oxo-1,6-dihydropyridazin-4-yl)-N-[(pyrazin-2-yl)methyl]piperidine-3-carboxamide
T424-0808 Screening compound: 1-(1-benzyl-6-oxo-1,6-dihydropyridazin-4-yl)-N-[(pyrazin-2-yl)methyl]piperidine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T424-0808
1-(1-benzyl-6-oxo-1,6-dihydropyridazin-4-yl)-N-[(pyrazin-2-yl)methyl]piperidine-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

T424-0808

Molecular Formula

C22H24N6O2 (C22 H24 N6 O2)

Compound Name

1-(1-benzyl-6-oxo-1,6-dihydropyridazin-4-yl)-N-[(pyrazin-2-yl)methyl]piperidine-3-carboxamide

IUPAC name

1-(1-benzyl-6-oxo-16-dihydropyridazin-4-yl)-N-[(pyrazin-2-yl)methyl]piperidine-3-carboxamide

SMILES

O=C(C(CCC1)CN1C(C=NN1Cc2ccccc2)=CC1=O)NCc1nccnc1

InChI

InChI=1S/C22H24N6O2/c29-21-11-20(14-26-28(21)15-17-5-2-1-3-6-17)27-10-4-7-18(16-27)22(30)25-13-19-12-23-8-9-24-19/h1-3,5-6,8-9,11-12,14,18H,4,7,10,13,15-16H2,(H,25,30)/t18-/m0/s1

InChI Key

MRHFEYAPKWEOMF-SFHVURJKSA-N

MDL Number (MFCD)

MFCD29022564

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.47

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

0.915

Distribution Coefficient, logD

0.897

Water Solubility, LogSw

-1.43

Polar Surface Area

75.901

Acid Dissociation Constant (pKa)

13.09

Base Dissociation Constant (pKb)

4.12

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.80

T424-0808 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with T424-0808 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T424-0808?
Check Price and Availability of T424-0808, 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 T424-0808 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T424-0808
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T424-0808
  • 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 T424-0808 available by request