K780-1359 Screening compound: methyl 2-{[2-(2,4-dimethylphenyl)-3,4-dimethyl-2H-pyrazolo[3,4-d]pyridazin-7-yl]sulfanyl}acetate

K780-1359 Screening compound: methyl 2-{[2-(2,4-dimethylphenyl)-3,4-dimethyl-2H-pyrazolo[3,4-d]pyridazin-7-yl]sulfanyl}acetate
K780-1359 Screening compound: methyl 2-{[2-(2,4-dimethylphenyl)-3,4-dimethyl-2H-pyrazolo[3,4-d]pyridazin-7-yl]sulfanyl}acetate alternative view

Chemical Structure Depiction of ChemDiv screening compound K780-1359
methyl 2-{[2-(2,4-dimethylphenyl)-3,4-dimethyl-2H-pyrazolo[3,4-d]pyridazin-7-yl]sulfanyl}acetate

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

K780-1359

Molecular Formula

C18H20N4O2S (C18 H20 N4 O2 S)

Compound Name

methyl 2-{[2-(2,4-dimethylphenyl)-3,4-dimethyl-2H-pyrazolo[3,4-d]pyridazin-7-yl]sulfanyl}acetate

IUPAC name

methyl 2-{[2-(24-dimethylphenyl)-34-dimethyl-2H-pyrazolo[34-d]pyridazin-7-yl]sulfanyl}acetate

SMILES

Cc(n(-c1c(C)cc(C)cc1)nc12)c2c(C)nnc1SCC(OC)=O

InChI

InChI=1S/C18H20N4O2S/c1-10-6-7-14(11(2)8-10)22-13(4)16-12(3)19-20-18(17(16)21-22)25-9-15(23)24-5/h6-8H,9H2,1-5H3

InChI Key

QSEZMWAZPZGQFW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14281072

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

356.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.179

Distribution Coefficient, logD

3.179

Water Solubility, LogSw

-3.46

Polar Surface Area

57.294

Acid Dissociation Constant (pKa)

19.75

Base Dissociation Constant (pKb)

4.14

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

33.30

K780-1359 in Drug Discovery

Included in Screening Libraries

Antifungal Library (16415 compounds)

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with K780-1359 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K780-1359?
Check Price and Availability of K780-1359, 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 K780-1359 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K780-1359
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K780-1359
  • 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 K780-1359 available by request