8020-4577 Screening compound: 4-(2-methylphenyl)-6-(3-methylphenyl)-2-oxo-1,2-dihydropyridine-3-carbonitrile

8020-4577 Screening compound: 4-(2-methylphenyl)-6-(3-methylphenyl)-2-oxo-1,2-dihydropyridine-3-carbonitrile
8020-4577 Screening compound: 4-(2-methylphenyl)-6-(3-methylphenyl)-2-oxo-1,2-dihydropyridine-3-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 8020-4577
4-(2-methylphenyl)-6-(3-methylphenyl)-2-oxo-1,2-dihydropyridine-3-carbonitrile

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

8020-4577

Molecular Formula

C20H16N2O (C20 H16 N2 O)

Compound Name

4-(2-methylphenyl)-6-(3-methylphenyl)-2-oxo-1,2-dihydropyridine-3-carbonitrile

IUPAC name

4-(2-methylphenyl)-6-(3-methylphenyl)-2-oxo-12-dihydropyridine-3-carbonitrile

SMILES

Cc1cccc(C(NC2=O)=CC(c3c(C)cccc3)=C2C#N)c1

InChI

InChI=1S/C20H16N2O/c1-13-6-5-8-15(10-13)19-11-17(18(12-21)20(23)22-19)16-9-4-3-7-14(16)2/h3-11H,1-2H3,(H,22,23)

InChI Key

AVTZZYIQMMVKQN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03922432

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

300.36

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.034

Distribution Coefficient, logD

1.505

Water Solubility, LogSw

-4.19

Polar Surface Area

41.986

Acid Dissociation Constant (pKa)

4.87

Base Dissociation Constant (pKb)

-6.41

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

8020-4577 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Anti-infective Library (19449 compounds)

Antiparasite Library (23996 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Infections
  • Immune system
  • animal
Mechanism of action:
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8020-4577 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8020-4577?
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What is the minimum amount of 8020-4577 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8020-4577
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8020-4577
  • 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 8020-4577 available by request