T424-0421 Screening compound: N~3~-{3-[3,4-dihydro-1(2H)-quinolinyl]propyl}-1-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-3-piperidinecarboxamide

T424-0421 Screening compound: N~3~-{3-[3,4-dihydro-1(2H)-quinolinyl]propyl}-1-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-3-piperidinecarboxamide
T424-0421 Screening compound: N~3~-{3-[3,4-dihydro-1(2H)-quinolinyl]propyl}-1-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-3-piperidinecarboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound T424-0421
N~3~-{3-[3,4-dihydro-1(2H)-quinolinyl]propyl}-1-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-3-piperidinecarboxamide

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

T424-0421

Molecular Formula

C23H31N5O2 (C23 H31 N5 O2)

Compound Name

N~3~-{3-[3,4-dihydro-1(2H)-quinolinyl]propyl}-1-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-3-piperidinecarboxamide

IUPAC name

n/a

SMILES

CN1N=CC(N(CCC2)CC2C(NCCCN(CCC2)c3c2cccc3)=O)=CC1=O

InChI

InChI=1S/C23H31N5O2/c1-26-22(29)15-20(16-25-26)28-13-5-9-19(17-28)23(30)24-11-6-14-27-12-4-8-18-7-2-3-10-21(18)27/h2-3,7,10,15-16,19H,4-6,8-9,11-14,17H2,1H3,(H,24,30)/t19-/m0/s1

InChI Key

FZBRPQVPUOFBMZ-IBGZPJMESA-N

MDL Number (MFCD)

MFCD29022894

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

409.53

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.974

Distribution Coefficient, logD

1.918

Water Solubility, LogSw

-2.39

Polar Surface Area

59.445

Acid Dissociation Constant (pKa)

14.43

Base Dissociation Constant (pKb)

7.77

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.20

T424-0421 in Drug Discovery

Included in Screening Libraries

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 T424-0421 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T424-0421?
Check Price and Availability of T424-0421, 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 T424-0421 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T424-0421
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T424-0421
  • 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 T424-0421 available by request