0777-4866 Screening compound: 4-acetamidophenyl pyridine-3-carboxylate

0777-4866 Screening compound: 4-acetamidophenyl pyridine-3-carboxylate
0777-4866 Screening compound: 4-acetamidophenyl pyridine-3-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 0777-4866
4-acetamidophenyl pyridine-3-carboxylate

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

0777-4866

Molecular Formula

C14H12N2O3 (C14 H12 N2 O3)

Compound Name

4-acetamidophenyl pyridine-3-carboxylate

IUPAC name

4-acetamidophenyl pyridine-3-carboxylate

SMILES

CC(Nc(cc1)ccc1OC(c1cnccc1)=O)=O

InChI

InChI=1S/C14H12N2O3/c1-10(17)16-12-4-6-13(7-5-12)19-14(18)11-3-2-8-15-9-11/h2-9H,1H3,(H,16,17)

InChI Key

QOHDTSVYCIETJO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00991754

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

256.26

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.116

Distribution Coefficient, logD

1.116

Water Solubility, LogSw

-1.10

Polar Surface Area

53.396

Acid Dissociation Constant (pKa)

12.61

Base Dissociation Constant (pKb)

0.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

7.10

0777-4866 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)

Serine Proteases Inhibitors Library (32732 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
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with 0777-4866 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0777-4866?
Check Price and Availability of 0777-4866, 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 0777-4866 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0777-4866
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0777-4866
  • 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 0777-4866 available by request