D653-0152 Screening compound: 1-(benzenesulfonyl)-4-[(pyridin-4-yl)methyl]piperazine

D653-0152 Screening compound: 1-(benzenesulfonyl)-4-[(pyridin-4-yl)methyl]piperazine
D653-0152 Screening compound: 1-(benzenesulfonyl)-4-[(pyridin-4-yl)methyl]piperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound D653-0152
1-(benzenesulfonyl)-4-[(pyridin-4-yl)methyl]piperazine

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

D653-0152

Molecular Formula

C16H19N3O2S (C16 H19 N3 O2 S)

Compound Name

1-(benzenesulfonyl)-4-[(pyridin-4-yl)methyl]piperazine

IUPAC name

1-(benzenesulfonyl)-4-[(pyridin-4-yl)methyl]piperazine

SMILES

O=S(c1ccccc1)(N1CCN(Cc2ccncc2)CC1)=O

InChI

InChI=1S/C16H19N3O2S/c20-22(21,16-4-2-1-3-5-16)19-12-10-18(11-13-19)14-15-6-8-17-9-7-15/h1-9H,10-14H2

InChI Key

QBQOAHSNCSOGBD-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02107417

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

317.41

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

1.148

Distribution Coefficient, logD

1.124

Water Solubility, LogSw

-1.97

Polar Surface Area

44.918

Acid Dissociation Constant (pKa)

28.13

Base Dissociation Constant (pKb)

6.16

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.30

D653-0152 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

CNS MPO Library (28609 compounds)

Regenerative Medicine Focused Library (23016 compounds)

STING Agonist Library (5895 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Nervous system
  • Musculoskeletal
  • Digestive system
  • Hemic and lymphatic
  • Cardiovascular
  • Skin
  • wounds
  • Cancer
  • Immune system
  • Nervous system
  • Cardiovascular
Mechanism of action:
  • Epigenetic
Targets:
  • Others
  • Ion Channels

References: we are preparing a list of scientific research reports with D653-0152 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D653-0152?
Check Price and Availability of D653-0152, 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 D653-0152 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D653-0152
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D653-0152
  • 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 D653-0152 available by request