J046-0332 Screening compound: 2-[3-(4-chlorophenyl)-5-acetamido-6-oxo-1,6-dihydropyridazin-1-yl]-N-(3,5-dimethylphenyl)acetamide

J046-0332 Screening compound: 2-[3-(4-chlorophenyl)-5-acetamido-6-oxo-1,6-dihydropyridazin-1-yl]-N-(3,5-dimethylphenyl)acetamide
J046-0332 Screening compound: 2-[3-(4-chlorophenyl)-5-acetamido-6-oxo-1,6-dihydropyridazin-1-yl]-N-(3,5-dimethylphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J046-0332
2-[3-(4-chlorophenyl)-5-acetamido-6-oxo-1,6-dihydropyridazin-1-yl]-N-(3,5-dimethylphenyl)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

J046-0332

Molecular Formula

C22H21ClN4O3 (C22 H21 ClN4 O3)

Compound Name

2-[3-(4-chlorophenyl)-5-acetamido-6-oxo-1,6-dihydropyridazin-1-yl]-N-(3,5-dimethylphenyl)acetamide

IUPAC name

2-[3-(4-chlorophenyl)-5-acetamido-6-oxo-16-dihydropyridazin-1-yl]-N-(35-dimethylphenyl)acetamide

SMILES

CC(NC1=CC(c(cc2)ccc2Cl)=NN(CC(Nc2cc(C)cc(C)c2)=O)C1=O)=O

InChI

InChI=1S/C22H21ClN4O3/c1-13-8-14(2)10-18(9-13)25-21(29)12-27-22(30)20(24-15(3)28)11-19(26-27)16-4-6-17(23)7-5-16/h4-11H,12H2,1-3H3,(H,24,28)(H,25,29)

InChI Key

HKONNLZGSDGSKT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27222291

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

424.89

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.724

Distribution Coefficient, logD

3.717

Water Solubility, LogSw

-4.24

Polar Surface Area

75.644

Acid Dissociation Constant (pKa)

9.23

Base Dissociation Constant (pKb)

-1.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.18

References: we are preparing a list of scientific research reports with J046-0332 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J046-0332?
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What is the minimum amount of J046-0332 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J046-0332
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J046-0332
  • 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 J046-0332 available by request