8512-0128 Screening compound: 4-cyano-2-fluoro-N-(2-methylquinolin-8-yl)benzamide

8512-0128 Screening compound: 4-cyano-2-fluoro-N-(2-methylquinolin-8-yl)benzamide
8512-0128 Screening compound: 4-cyano-2-fluoro-N-(2-methylquinolin-8-yl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8512-0128
4-cyano-2-fluoro-N-(2-methylquinolin-8-yl)benzamide

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

8512-0128

Molecular Formula

C18H12FN3O (C18 H12 FN3 O)

Compound Name

4-cyano-2-fluoro-N-(2-methylquinolin-8-yl)benzamide

IUPAC name

4-cyano-2-fluoro-N-(2-methylquinolin-8-yl)benzamide

SMILES

Cc1ccc(cccc2NC(c(ccc(C#N)c3)c3F)=O)c2n1

InChI

InChI=1S/C18H12FN3O/c1-11-5-7-13-3-2-4-16(17(13)21-11)22-18(23)14-8-6-12(10-20)9-15(14)19/h2-9H,1H3,(H,22,23)

InChI Key

QDINAMRPNZZVKS-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07177017

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

305.31

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

3.789

Distribution Coefficient, logD

3.733

Water Solubility, LogSw

-3.98

Polar Surface Area

48.596

Acid Dissociation Constant (pKa)

8.27

Base Dissociation Constant (pKb)

4.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

5.60

8512-0128 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

PI3K-Targeted Library (17255 compounds)

RAR (Nuclear receptors) Ligands Library (6524 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
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Cancer
  • Respiratory tract
  • Eye
  • Male
  • Female
  • Hemic and lymphatic
  • Congenital
  • Skin
  • Endocrine
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Targets:
  • Kinases
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands
  • Epigenetic

References: we are preparing a list of scientific research reports with 8512-0128 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8512-0128?
Check Price and Availability of 8512-0128, 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 8512-0128 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8512-0128
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8512-0128
  • 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 8512-0128 available by request