4338-0722 Screening compound: 6-hydroxy-4-methyl-2-oxo-1-(2-phenylethyl)-1,2-dihydropyridine-3-carbonitrile

4338-0722 Screening compound: 6-hydroxy-4-methyl-2-oxo-1-(2-phenylethyl)-1,2-dihydropyridine-3-carbonitrile
4338-0722 Screening compound: 6-hydroxy-4-methyl-2-oxo-1-(2-phenylethyl)-1,2-dihydropyridine-3-carbonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound 4338-0722
6-hydroxy-4-methyl-2-oxo-1-(2-phenylethyl)-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

4338-0722

Molecular Formula

C15H14N2O2 (C15 H14 N2 O2)

Compound Name

6-hydroxy-4-methyl-2-oxo-1-(2-phenylethyl)-1,2-dihydropyridine-3-carbonitrile

IUPAC name

6-hydroxy-4-methyl-2-oxo-1-(2-phenylethyl)-12-dihydropyridine-3-carbonitrile

SMILES

CC(C=C(N(CCc1ccccc1)C1=O)O)=C1C#N

InChI

InChI=1S/C15H14N2O2/c1-11-9-14(18)17(15(19)13(11)10-16)8-7-12-5-3-2-4-6-12/h2-6,9,18H,7-8H2,1H3

InChI Key

KNJDFOJTZWZPLC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD03216981

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

254.29

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.970

Distribution Coefficient, logD

-2.638

Water Solubility, LogSw

-1.84

Polar Surface Area

49.605

Acid Dissociation Constant (pKa)

2.79

Base Dissociation Constant (pKb)

-2.98

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

4338-0722 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Human GPCR Annotated Library (5539 compounds)

Soluble Diversity Library (15920 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
  • Epigenetic
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 4338-0722 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4338-0722?
Check Price and Availability of 4338-0722, 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 4338-0722 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4338-0722
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4338-0722
  • 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 4338-0722 available by request