E860-2583 Screening compound: N-[(4-chlorophenyl)methyl]-2-({3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl}sulfanyl)acetamide

E860-2583 Screening compound: N-[(4-chlorophenyl)methyl]-2-({3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl}sulfanyl)acetamide
E860-2583 Screening compound: N-[(4-chlorophenyl)methyl]-2-({3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl}sulfanyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E860-2583
N-[(4-chlorophenyl)methyl]-2-({3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl}sulfanyl)acetamide

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

E860-2583

Molecular Formula

C22H20ClN5OS (C22 H20 ClN5 OS)

Compound Name

N-[(4-chlorophenyl)methyl]-2-({3,4-dimethyl-2-phenyl-2H-pyrazolo[3,4-d]pyridazin-7-yl}sulfanyl)acetamide

IUPAC name

N-[(4-chlorophenyl)methyl]-2-({34-dimethyl-2-phenyl-2H-pyrazolo[34-d]pyridazin-7-yl}sulfanyl)acetamide

SMILES

Cc(n(-c1ccccc1)nc12)c2c(C)nnc1SCC(NCc(cc1)ccc1Cl)=O

InChI

InChI=1S/C22H20ClN5OS/c1-14-20-15(2)28(18-6-4-3-5-7-18)27-21(20)22(26-25-14)30-13-19(29)24-12-16-8-10-17(23)11-9-16/h3-11H,12-13H2,1-2H3,(H,24,29)

InChI Key

GOGQWXCUCYKCEJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14924051

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

437.95

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.662

Distribution Coefficient, logD

3.662

Water Solubility, LogSw

-4.26

Polar Surface Area

61.216

Acid Dissociation Constant (pKa)

12.79

Base Dissociation Constant (pKb)

3.03

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

E860-2583 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators

References: we are preparing a list of scientific research reports with E860-2583 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E860-2583?
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What is the minimum amount of E860-2583 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E860-2583
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E860-2583
  • 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 E860-2583 available by request