D223-0542 Screening compound: N-[2-(4-methylbenzoyl)-1-benzofuran-3-yl]-1-(4-methylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide

D223-0542 Screening compound: N-[2-(4-methylbenzoyl)-1-benzofuran-3-yl]-1-(4-methylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide
D223-0542 Screening compound: N-[2-(4-methylbenzoyl)-1-benzofuran-3-yl]-1-(4-methylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound D223-0542
N-[2-(4-methylbenzoyl)-1-benzofuran-3-yl]-1-(4-methylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide

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

D223-0542

Molecular Formula

C28H21N3O4 (C28 H21 N3 O4)

Compound Name

N-[2-(4-methylbenzoyl)-1-benzofuran-3-yl]-1-(4-methylphenyl)-4-oxo-1,4-dihydropyridazine-3-carboxamide

IUPAC name

N-[2-(4-methylbenzoyl)-1-benzofuran-3-yl]-1-(4-methylphenyl)-4-oxo-14-dihydropyridazine-3-carboxamide

SMILES

Cc(cc1)ccc1C(c(oc1c2cccc1)c2NC(C(C(C=C1)=O)=NN1c1ccc(C)cc1)=O)=O

InChI

InChI=1S/C28H21N3O4/c1-17-7-11-19(12-8-17)26(33)27-24(21-5-3-4-6-23(21)35-27)29-28(34)25-22(32)15-16-31(30-25)20-13-9-18(2)10-14-20/h3-16H,1-2H3,(H,29,34)

InChI Key

GORAJHMOPWZHCW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD08549171

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

463.49

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

5.233

Distribution Coefficient, logD

4.368

Water Solubility, LogSw

-5.32

Polar Surface Area

70.337

Acid Dissociation Constant (pKa)

6.60

Base Dissociation Constant (pKb)

-0.13

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

D223-0542 in Drug Discovery

Included in Screening Libraries

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with D223-0542 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D223-0542?
Check Price and Availability of D223-0542, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of D223-0542 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D223-0542
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D223-0542
  • 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 D223-0542 available by request