3931-2960 Screening compound: 3-(benzenesulfonyl)-3-(4-methoxyphenyl)-1-phenylpropan-1-one

3931-2960 Screening compound: 3-(benzenesulfonyl)-3-(4-methoxyphenyl)-1-phenylpropan-1-one
3931-2960 Screening compound: 3-(benzenesulfonyl)-3-(4-methoxyphenyl)-1-phenylpropan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 3931-2960
3-(benzenesulfonyl)-3-(4-methoxyphenyl)-1-phenylpropan-1-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

3931-2960

Molecular Formula

C22H20O4S (C22 H20 O4 S)

Compound Name

3-(benzenesulfonyl)-3-(4-methoxyphenyl)-1-phenylpropan-1-one

IUPAC name

3-(benzenesulfonyl)-3-(4-methoxyphenyl)-1-phenylpropan-1-one

SMILES

COc1ccc(C(CC(c2ccccc2)=O)S(c2ccccc2)(=O)=O)cc1

InChI

InChI=1S/C22H20O4S/c1-26-19-14-12-18(13-15-19)22(16-21(23)17-8-4-2-5-9-17)27(24,25)20-10-6-3-7-11-20/h2-15,22H,16H2,1H3/t22-/m0/s1

InChI Key

UKAUPWVVVABNBV-QFIPXVFZSA-N

MDL Number (MFCD)

MFCD02225398

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

380.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

4.100

Distribution Coefficient, logD

4.100

Water Solubility, LogSw

-4.29

Polar Surface Area

50.258

Acid Dissociation Constant (pKa)

16.80

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

13.60

3931-2960 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Anti-infective Library (19449 compounds)

Antifungal Library (16415 compounds)

Antiviral Annotated Library (21441 compounds)

Human Receptors Annotated Library (5376 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Infections
  • Immune system
  • animal
  • Infections
  • Immune system
  • animal
Targets:
  • Kinases
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 3931-2960 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3931-2960?
Check Price and Availability of 3931-2960, 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 3931-2960 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3931-2960
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3931-2960
  • 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 3931-2960 available by request