D216-0292 Screening compound: 1-(4-{[4-(4-methoxyphenoxy)piperidin-1-yl]sulfonyl}phenyl)ethan-1-one

D216-0292 Screening compound: 1-(4-{[4-(4-methoxyphenoxy)piperidin-1-yl]sulfonyl}phenyl)ethan-1-one
D216-0292 Screening compound: 1-(4-{[4-(4-methoxyphenoxy)piperidin-1-yl]sulfonyl}phenyl)ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound D216-0292
1-(4-{[4-(4-methoxyphenoxy)piperidin-1-yl]sulfonyl}phenyl)ethan-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

D216-0292

Molecular Formula

C20H23NO5S (C20 H23 NO5 S)

Compound Name

1-(4-{[4-(4-methoxyphenoxy)piperidin-1-yl]sulfonyl}phenyl)ethan-1-one

IUPAC name

1-(4-{[4-(4-methoxyphenoxy)piperidin-1-yl]sulfonyl}phenyl)ethan-1-one

SMILES

CC(c(cc1)ccc1S(N(CC1)CCC1Oc(cc1)ccc1OC)(=O)=O)=O

InChI

InChI=1S/C20H23NO5S/c1-15(22)16-3-9-20(10-4-16)27(23,24)21-13-11-19(12-14-21)26-18-7-5-17(25-2)6-8-18/h3-10,19H,11-14H2,1-2H3

InChI Key

IOIOXUXMXNAIOP-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14814339

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

389.47

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.055

Distribution Coefficient, logD

3.055

Water Solubility, LogSw

-3.30

Polar Surface Area

59.582

Acid Dissociation Constant (pKa)

21.69

Base Dissociation Constant (pKb)

-4.73

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

35.00

D216-0292 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

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

CNS targets activity set (6557 compounds)

Dark Chemical Matter Library (18430 compounds)

Human GPCR Annotated Library (5539 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic
  • PPI modulators
Structure:
  • Pool
  • Cyclic compounds

References: we are preparing a list of scientific research reports with D216-0292 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D216-0292?
Check Price and Availability of D216-0292, 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 D216-0292 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D216-0292
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D216-0292
  • 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 D216-0292 available by request