5504-0224 Screening compound: 2-methyl-6-{[6-methyl-2-(methylsulfanyl)pyrimidin-4-yl]oxy}-2,3-dihydropyridazin-3-one

5504-0224 Screening compound: 2-methyl-6-{[6-methyl-2-(methylsulfanyl)pyrimidin-4-yl]oxy}-2,3-dihydropyridazin-3-one
5504-0224 Screening compound: 2-methyl-6-{[6-methyl-2-(methylsulfanyl)pyrimidin-4-yl]oxy}-2,3-dihydropyridazin-3-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 5504-0224
2-methyl-6-{[6-methyl-2-(methylsulfanyl)pyrimidin-4-yl]oxy}-2,3-dihydropyridazin-3-one

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

5504-0224

Molecular Formula

C11H12N4O2S (C11 H12 N4 O2 S)

Compound Name

2-methyl-6-{[6-methyl-2-(methylsulfanyl)pyrimidin-4-yl]oxy}-2,3-dihydropyridazin-3-one

IUPAC name

2-methyl-6-{[6-methyl-2-(methylsulfanyl)pyrimidin-4-yl]oxy}-23-dihydropyridazin-3-one

SMILES

Cc1nc(SC)nc(OC(C=C2)=NN(C)C2=O)c1

InChI

InChI=1S/C11H12N4O2S/c1-7-6-9(13-11(12-7)18-3)17-8-4-5-10(16)15(2)14-8/h4-6H,1-3H3

InChI Key

KLSCTCFVDMDBHI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03502172

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

264.31

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.383

Distribution Coefficient, logD

1.383

Water Solubility, LogSw

-1.73

Polar Surface Area

53.603

Acid Dissociation Constant (pKa)

25.89

Base Dissociation Constant (pKb)

-0.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

27.30

5504-0224 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Cardiovascular Library (22201 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cardiovascular
Agro:
  • Agro
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 5504-0224 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5504-0224?
Check Price and Availability of 5504-0224, 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 5504-0224 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5504-0224
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5504-0224
  • 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 5504-0224 available by request