Y031-6632 Screening compound: N-(3,4-difluorophenyl)pyridine-3-carboxamide

Y031-6632 Screening compound: N-(3,4-difluorophenyl)pyridine-3-carboxamide
Y031-6632 Screening compound: N-(3,4-difluorophenyl)pyridine-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound Y031-6632
N-(3,4-difluorophenyl)pyridine-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

Y031-6632

Molecular Formula

C12H8F2N2O (C12 H8 F2 N2 O)

Compound Name

N-(3,4-difluorophenyl)pyridine-3-carboxamide

IUPAC name

N-(34-difluorophenyl)pyridine-3-carboxamide

SMILES

O=C(c1cnccc1)Nc(cc1)cc(F)c1F

InChI

InChI=1S/C12H8F2N2O/c13-10-4-3-9(6-11(10)14)16-12(17)8-2-1-5-15-7-8/h1-7H,(H,16,17)

InChI Key

UHQUVLUBUXSBBY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01213565

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

234.21

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

2.189

Distribution Coefficient, logD

1.773

Water Solubility, LogSw

-2.63

Polar Surface Area

32.847

Acid Dissociation Constant (pKa)

7.19

Base Dissociation Constant (pKb)

2.81

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

Y031-6632 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiviral Annotated Library (21441 compounds)

Cardiovascular Library (22201 compounds)

Dark Chemical Matter Library (18430 compounds)

Human Receptors Annotated Library (5376 compounds)

Soluble Diversity Library (15920 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
Therapeutical areas:
  • Cardiovascular
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with Y031-6632 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound Y031-6632?
Check Price and Availability of Y031-6632, 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 Y031-6632 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for Y031-6632
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for Y031-6632
  • 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 Y031-6632 available by request