F195-0001 Screening compound: 3-(benzenesulfonyl)-4,6-dimethyl-1,2-dihydropyridin-2-one

F195-0001 Screening compound: 3-(benzenesulfonyl)-4,6-dimethyl-1,2-dihydropyridin-2-one
F195-0001 Screening compound: 3-(benzenesulfonyl)-4,6-dimethyl-1,2-dihydropyridin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound F195-0001
3-(benzenesulfonyl)-4,6-dimethyl-1,2-dihydropyridin-2-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

F195-0001

Molecular Formula

C13H13NO3S (C13 H13 NO3 S)

Compound Name

3-(benzenesulfonyl)-4,6-dimethyl-1,2-dihydropyridin-2-one

IUPAC name

3-(benzenesulfonyl)-46-dimethyl-12-dihydropyridin-2-one

SMILES

CC(C=C(C)NC1=O)=C1S(c1ccccc1)(=O)=O

InChI

InChI=1S/C13H13NO3S/c1-9-8-10(2)14-13(15)12(9)18(16,17)11-6-4-3-5-7-11/h3-8H,1-2H3,(H,14,15)

InChI Key

CPEXOJPJKDYPDN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00974850

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

263.32

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.516

Distribution Coefficient, logD

1.284

Water Solubility, LogSw

-2.41

Polar Surface Area

54.473

Acid Dissociation Constant (pKa)

7.55

Base Dissociation Constant (pKb)

-4.49

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

15.40

F195-0001 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Antiparasite Library (23996 compounds)

Dark Chemical Matter Library (18430 compounds)

Fragments Library (11262 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Neuropeptide S Library (2850 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
  • Pool
  • Fragments
Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Digestive system
  • Nervous system
Agro:
  • Agro
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
Targets:
  • GPCR

References: we are preparing a list of scientific research reports with F195-0001 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F195-0001?
Check Price and Availability of F195-0001, 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 F195-0001 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F195-0001
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F195-0001
  • 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 F195-0001 available by request