T424-0819 Screening compound: ethyl 4-[1-(1-benzyl-6-oxo-1,6-dihydropyridazin-4-yl)piperidine-3-amido]piperidine-1-carboxylate

T424-0819 Screening compound: ethyl 4-[1-(1-benzyl-6-oxo-1,6-dihydropyridazin-4-yl)piperidine-3-amido]piperidine-1-carboxylate
T424-0819 Screening compound: ethyl 4-[1-(1-benzyl-6-oxo-1,6-dihydropyridazin-4-yl)piperidine-3-amido]piperidine-1-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound T424-0819
ethyl 4-[1-(1-benzyl-6-oxo-1,6-dihydropyridazin-4-yl)piperidine-3-amido]piperidine-1-carboxylate

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

T424-0819

Molecular Formula

C25H33N5O4 (C25 H33 N5 O4)

Compound Name

ethyl 4-[1-(1-benzyl-6-oxo-1,6-dihydropyridazin-4-yl)piperidine-3-amido]piperidine-1-carboxylate

IUPAC name

ethyl 4-[1-(1-benzyl-6-oxo-16-dihydropyridazin-4-yl)piperidine-3-amido]piperidine-1-carboxylate

SMILES

CCOC(N(CC1)CCC1NC(C(CCC1)CN1C(C=NN1Cc2ccccc2)=CC1=O)=O)=O

InChI

InChI=1S/C25H33N5O4/c1-2-34-25(33)28-13-10-21(11-14-28)27-24(32)20-9-6-12-29(18-20)22-15-23(31)30(26-16-22)17-19-7-4-3-5-8-19/h3-5,7-8,15-16,20-21H,2,6,9-14,17-18H2,1H3,(H,27,32)/t20-/m0/s1

InChI Key

BFQZPKWSOADJIF-FQEVSTJZSA-N

MDL Number (MFCD)

MFCD29022575

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.57

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.009

Distribution Coefficient, logD

1.991

Water Solubility, LogSw

-2.36

Polar Surface Area

79.346

Acid Dissociation Constant (pKa)

15.62

Base Dissociation Constant (pKb)

6.04

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

52.00

T424-0819 in Drug Discovery

Included in Screening Libraries

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

Anti-HIV1 Library (19540 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with T424-0819 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound T424-0819?
Check Price and Availability of T424-0819, 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 T424-0819 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for T424-0819
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for T424-0819
  • 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 T424-0819 available by request