J046-0343 Screening compound: 2-[3-(4-chlorophenyl)-5-acetamido-6-oxo-1,6-dihydropyridazin-1-yl]-N-[2-(propan-2-yl)phenyl]acetamide

J046-0343 Screening compound: 2-[3-(4-chlorophenyl)-5-acetamido-6-oxo-1,6-dihydropyridazin-1-yl]-N-[2-(propan-2-yl)phenyl]acetamide
J046-0343 Screening compound: 2-[3-(4-chlorophenyl)-5-acetamido-6-oxo-1,6-dihydropyridazin-1-yl]-N-[2-(propan-2-yl)phenyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J046-0343
2-[3-(4-chlorophenyl)-5-acetamido-6-oxo-1,6-dihydropyridazin-1-yl]-N-[2-(propan-2-yl)phenyl]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

J046-0343

Molecular Formula

C23H23ClN4O3 (C23 H23 ClN4 O3)

Compound Name

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

IUPAC name

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

SMILES

CC(C)c(cccc1)c1NC(CN(C(C(NC(C)=O)=C1)=O)N=C1c(cc1)ccc1Cl)=O

InChI

InChI=1S/C23H23ClN4O3/c1-14(2)18-6-4-5-7-19(18)26-22(30)13-28-23(31)21(25-15(3)29)12-20(27-28)16-8-10-17(24)11-9-16/h4-12,14H,13H2,1-3H3,(H,25,29)(H,26,30)

InChI Key

XYAGLQYUMCLTFG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27222292

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

438.91

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

3.638

Distribution Coefficient, logD

3.632

Water Solubility, LogSw

-4.13

Polar Surface Area

74.947

Acid Dissociation Constant (pKa)

9.23

Base Dissociation Constant (pKb)

-1.90

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

J046-0343 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with J046-0343 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J046-0343?
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What is the minimum amount of J046-0343 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J046-0343
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J046-0343
  • 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 J046-0343 available by request