0777-4946 Screening compound: 2-ethyl 6-phenyl pyridine-2,6-dicarboxylate

0777-4946 Screening compound: 2-ethyl 6-phenyl pyridine-2,6-dicarboxylate
0777-4946 Screening compound: 2-ethyl 6-phenyl pyridine-2,6-dicarboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0777-4946
2-ethyl 6-phenyl pyridine-2,6-dicarboxylate

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

0777-4946

Molecular Formula

C15H13NO4 (C15 H13 NO4)

Compound Name

2-ethyl 6-phenyl pyridine-2,6-dicarboxylate

IUPAC name

2-ethyl 6-phenyl pyridine-26-dicarboxylate

SMILES

CCOC(c1cccc(C(Oc2ccccc2)=O)n1)=O

InChI

InChI=1S/C15H13NO4/c1-2-19-14(17)12-9-6-10-13(16-12)15(18)20-11-7-4-3-5-8-11/h3-10H,2H2,1H3

InChI Key

DIUVUOFZAFGUHX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01535937

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

271.27

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.928

Distribution Coefficient, logD

2.928

Water Solubility, LogSw

-3.10

Polar Surface Area

49.986

Acid Dissociation Constant (pKa)

30.24

Base Dissociation Constant (pKb)

-1.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

0777-4946 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

Dark Chemical Matter Library (18430 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 0777-4946 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0777-4946?
Check Price and Availability of 0777-4946, 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 0777-4946 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0777-4946
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0777-4946
  • 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 0777-4946 available by request