5922-0078 Screening compound: 2-methyl-6-[(6-methyl-2-{[2-(4-methylphenoxy)ethyl]sulfanyl}-4-pyrimidinyl)oxy]-3(2H)-pyridazinone

5922-0078 Screening compound: 2-methyl-6-[(6-methyl-2-{[2-(4-methylphenoxy)ethyl]sulfanyl}-4-pyrimidinyl)oxy]-3(2H)-pyridazinone
5922-0078 Screening compound: 2-methyl-6-[(6-methyl-2-{[2-(4-methylphenoxy)ethyl]sulfanyl}-4-pyrimidinyl)oxy]-3(2H)-pyridazinone alternative view

Chemical Structure Depiction of ChemDiv screening compound 5922-0078
2-methyl-6-[(6-methyl-2-{[2-(4-methylphenoxy)ethyl]sulfanyl}-4-pyrimidinyl)oxy]-3(2H)-pyridazinone

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

5922-0078

Molecular Formula

C19H20N4O3S (C19 H20 N4 O3 S)

Compound Name

2-methyl-6-[(6-methyl-2-{[2-(4-methylphenoxy)ethyl]sulfanyl}-4-pyrimidinyl)oxy]-3(2H)-pyridazinone

IUPAC name

n/a

SMILES

Cc(cc1)ccc1OCCSc1nc(OC(C=C2)=NN(C)C2=O)cc(C)n1

InChI

InChI=1S/C19H20N4O3S/c1-13-4-6-15(7-5-13)25-10-11-27-19-20-14(2)12-17(21-19)26-16-8-9-18(24)23(3)22-16/h4-9,12H,10-11H2,1-3H3

InChI Key

UVHGQXVNQNJECK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14710910

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

384.46

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.193

Distribution Coefficient, logD

3.193

Water Solubility, LogSw

-3.33

Polar Surface Area

60.749

Acid Dissociation Constant (pKa)

23.06

Base Dissociation Constant (pKb)

-0.02

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

26.30

5922-0078 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 5922-0078 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5922-0078?
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What is the minimum amount of 5922-0078 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5922-0078
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5922-0078
  • 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 5922-0078 available by request