G885-0052 Screening compound: 4-[1-(4-ethoxybenzenesulfonyl)piperidin-4-yl]pyridine

G885-0052 Screening compound: 4-[1-(4-ethoxybenzenesulfonyl)piperidin-4-yl]pyridine
G885-0052 Screening compound: 4-[1-(4-ethoxybenzenesulfonyl)piperidin-4-yl]pyridine alternative view

Chemical Structure Depiction of ChemDiv screening compound G885-0052
4-[1-(4-ethoxybenzenesulfonyl)piperidin-4-yl]pyridine

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

G885-0052

Molecular Formula

C18H22N2O3S (C18 H22 N2 O3 S)

Compound Name

4-[1-(4-ethoxybenzenesulfonyl)piperidin-4-yl]pyridine

IUPAC name

4-[1-(4-ethoxybenzenesulfonyl)piperidin-4-yl]pyridine

SMILES

CCOc(cc1)ccc1S(N(CC1)CCC1c1ccncc1)(=O)=O

InChI

InChI=1S/C18H22N2O3S/c1-2-23-17-3-5-18(6-4-17)24(21,22)20-13-9-16(10-14-20)15-7-11-19-12-8-15/h3-8,11-12,16H,2,9-10,13-14H2,1H3

InChI Key

ZDOGZEJQCKVLKO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD15072701

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

346.45

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.367

Distribution Coefficient, logD

3.320

Water Solubility, LogSw

-3.19

Polar Surface Area

48.230

Acid Dissociation Constant (pKa)

25.62

Base Dissociation Constant (pKb)

6.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

38.90

G885-0052 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

CNS MPO Library (28609 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:
  • Nervous system
Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with G885-0052 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G885-0052?
Check Price and Availability of G885-0052, 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 G885-0052 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G885-0052
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G885-0052
  • 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 G885-0052 available by request