J046-1106 Screening compound: 2-methyl-N-[6-(4-methylphenyl)-3-oxo-2-[(phenylcarbamoyl)methyl]-2,3-dihydropyridazin-4-yl]propanamide

J046-1106 Screening compound: 2-methyl-N-[6-(4-methylphenyl)-3-oxo-2-[(phenylcarbamoyl)methyl]-2,3-dihydropyridazin-4-yl]propanamide
J046-1106 Screening compound: 2-methyl-N-[6-(4-methylphenyl)-3-oxo-2-[(phenylcarbamoyl)methyl]-2,3-dihydropyridazin-4-yl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J046-1106
2-methyl-N-[6-(4-methylphenyl)-3-oxo-2-[(phenylcarbamoyl)methyl]-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

J046-1106

Molecular Formula

C23H24N4O3 (C23 H24 N4 O3)

Compound Name

2-methyl-N-[6-(4-methylphenyl)-3-oxo-2-[(phenylcarbamoyl)methyl]-2,3-dihydropyridazin-4-yl]propanamide

IUPAC name

2-methyl-N-[6-(4-methylphenyl)-3-oxo-2-[(phenylcarbamoyl)methyl]-23-dihydropyridazin-4-yl]propanamide

SMILES

CC(C)C(NC1=CC(c2ccc(C)cc2)=NN(CC(Nc2ccccc2)=O)C1=O)=O

InChI

InChI=1S/C23H24N4O3/c1-15(2)22(29)25-20-13-19(17-11-9-16(3)10-12-17)26-27(23(20)30)14-21(28)24-18-7-5-4-6-8-18/h4-13,15H,14H2,1-3H3,(H,24,28)(H,25,29)

InChI Key

DHDJOWIJPNIYKB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27222491

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

404.47

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

3.762

Distribution Coefficient, logD

3.742

Water Solubility, LogSw

-3.94

Polar Surface Area

75.745

Acid Dissociation Constant (pKa)

8.72

Base Dissociation Constant (pKb)

-1.87

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

References: we are preparing a list of scientific research reports with J046-1106 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J046-1106?
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What is the minimum amount of J046-1106 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J046-1106
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J046-1106
  • 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 J046-1106 available by request