S020-2323 Screening compound: 7-(2-chlorobenzoyl)-2-(4-fluorophenyl)-1H,4H,5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-4-one

S020-2323 Screening compound: 7-(2-chlorobenzoyl)-2-(4-fluorophenyl)-1H,4H,5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-4-one
S020-2323 Screening compound: 7-(2-chlorobenzoyl)-2-(4-fluorophenyl)-1H,4H,5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound S020-2323
7-(2-chlorobenzoyl)-2-(4-fluorophenyl)-1H,4H,5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-4-one

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

S020-2323

Molecular Formula

C20H15ClFN3O2 (C20 H15 ClFN3 O2)

Compound Name

7-(2-chlorobenzoyl)-2-(4-fluorophenyl)-1H,4H,5H,6H,7H,8H-pyrido[3,4-d]pyrimidin-4-one

IUPAC name

7-(2-chlorobenzoyl)-2-(4-fluorophenyl)-1H4H5H6H7H8H-pyrido[34-d]pyrimidin-4-one

SMILES

O=C(c(cccc1)c1Cl)N(CC1)CC(NC(c(cc2)ccc2F)=N2)=C1C2=O

InChI

InChI=1S/C20H15ClFN3O2/c21-16-4-2-1-3-14(16)20(27)25-10-9-15-17(11-25)23-18(24-19(15)26)12-5-7-13(22)8-6-12/h1-8H,9-11H2,(H,23,24,26)

InChI Key

WBJBPUCHNPFXQF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD29029205

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

383.81

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.661

Distribution Coefficient, logD

-0.197

Water Solubility, LogSw

-3.83

Polar Surface Area

51.251

Acid Dissociation Constant (pKa)

4.54

Base Dissociation Constant (pKb)

3.24

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.00

S020-2323 in Drug Discovery

Included in Screening Libraries

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

GPCR Targeted Library (31838 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

SmartTM Library (51161 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Targets:
  • GPCR
  • Proteases
Mechanism of action:
  • Receptor's ligands
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
Agro:
  • Agro

References: we are preparing a list of scientific research reports with S020-2323 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S020-2323?
Check Price and Availability of S020-2323, 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 S020-2323 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S020-2323
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S020-2323
  • 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 S020-2323 available by request