J046-0521 Screening compound: N-(2-{[(3,5-dimethylphenyl)carbamoyl]methyl}-6-(4-methylphenyl)-3-oxo-2,3-dihydropyridazin-4-yl)propanamide

J046-0521 Screening compound: N-(2-{[(3,5-dimethylphenyl)carbamoyl]methyl}-6-(4-methylphenyl)-3-oxo-2,3-dihydropyridazin-4-yl)propanamide
J046-0521 Screening compound: N-(2-{[(3,5-dimethylphenyl)carbamoyl]methyl}-6-(4-methylphenyl)-3-oxo-2,3-dihydropyridazin-4-yl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J046-0521
N-(2-{[(3,5-dimethylphenyl)carbamoyl]methyl}-6-(4-methylphenyl)-3-oxo-2,3-dihydropyridazin-4-yl)propanamide

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

J046-0521

Molecular Formula

C24H26N4O3 (C24 H26 N4 O3)

Compound Name

N-(2-{[(3,5-dimethylphenyl)carbamoyl]methyl}-6-(4-methylphenyl)-3-oxo-2,3-dihydropyridazin-4-yl)propanamide

IUPAC name

N-(2-{[(35-dimethylphenyl)carbamoyl]methyl}-6-(4-methylphenyl)-3-oxo-23-dihydropyridazin-4-yl)propanamide

SMILES

CCC(NC1=CC(c2ccc(C)cc2)=NN(CC(Nc2cc(C)cc(C)c2)=O)C1=O)=O

InChI

InChI=1S/C24H26N4O3/c1-5-22(29)26-21-13-20(18-8-6-15(2)7-9-18)27-28(24(21)31)14-23(30)25-19-11-16(3)10-17(4)12-19/h6-13H,5,14H2,1-4H3,(H,25,30)(H,26,29)

InChI Key

UICMWFWZXJGFMW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27222359

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.5

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.050

Distribution Coefficient, logD

4.039

Water Solubility, LogSw

-3.98

Polar Surface Area

75.532

Acid Dissociation Constant (pKa)

8.98

Base Dissociation Constant (pKb)

4.06

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with J046-0521 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J046-0521?
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What is the minimum amount of J046-0521 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J046-0521
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J046-0521
  • 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 J046-0521 available by request