J046-0129 Screening compound: 2-[5-acetamido-3-(4-methylphenyl)-6-oxo-1,6-dihydropyridazin-1-yl]-N-(3-methoxyphenyl)acetamide

J046-0129 Screening compound: 2-[5-acetamido-3-(4-methylphenyl)-6-oxo-1,6-dihydropyridazin-1-yl]-N-(3-methoxyphenyl)acetamide
J046-0129 Screening compound: 2-[5-acetamido-3-(4-methylphenyl)-6-oxo-1,6-dihydropyridazin-1-yl]-N-(3-methoxyphenyl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J046-0129
2-[5-acetamido-3-(4-methylphenyl)-6-oxo-1,6-dihydropyridazin-1-yl]-N-(3-methoxyphenyl)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

J046-0129

Molecular Formula

C22H22N4O4 (C22 H22 N4 O4)

Compound Name

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

IUPAC name

2-[5-acetamido-3-(4-methylphenyl)-6-oxo-16-dihydropyridazin-1-yl]-N-(3-methoxyphenyl)acetamide

SMILES

CC(NC1=CC(c2ccc(C)cc2)=NN(CC(Nc2cc(OC)ccc2)=O)C1=O)=O

InChI

InChI=1S/C22H22N4O4/c1-14-7-9-16(10-8-14)19-12-20(23-15(2)27)22(29)26(25-19)13-21(28)24-17-5-4-6-18(11-17)30-3/h4-12H,13H2,1-3H3,(H,23,27)(H,24,28)

InChI Key

NGHNXFFDULREII-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27222218

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.44

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.926

Distribution Coefficient, logD

2.919

Water Solubility, LogSw

-3.29

Polar Surface Area

83.188

Acid Dissociation Constant (pKa)

9.23

Base Dissociation Constant (pKb)

-1.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.20

References: we are preparing a list of scientific research reports with J046-0129 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J046-0129?
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What is the minimum amount of J046-0129 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J046-0129
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J046-0129
  • 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 J046-0129 available by request