H025-0442C Screening compound: 1-[5-(benzenesulfinyl)pyridine-2-carbonyl]-4-methylpiperazine

H025-0442C Screening compound: 1-[5-(benzenesulfinyl)pyridine-2-carbonyl]-4-methylpiperazine
H025-0442C Screening compound: 1-[5-(benzenesulfinyl)pyridine-2-carbonyl]-4-methylpiperazine alternative view

Chemical Structure Depiction of ChemDiv screening compound H025-0442C
1-[5-(benzenesulfinyl)pyridine-2-carbonyl]-4-methylpiperazine

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

H025-0442C

Molecular Formula

C17H19N3O2S (C17 H19 N3 O2 S)

Compound Name

1-[5-(benzenesulfinyl)pyridine-2-carbonyl]-4-methylpiperazine

IUPAC name

1-[5-(benzenesulfinyl)pyridine-2-carbonyl]-4-methylpiperazine

SMILES

CN(CC1)CCN1C(c(cc1)ncc1S(c1ccccc1)=O)=O

InChI

InChI=1S/C17H21N3O2S/c1-19-9-11-20(12-10-19)17(21)16-8-7-15(13-18-16)23(22)14-5-3-2-4-6-14/h2-8,13H,9-12,23H2,1H3

InChI Key

VXFFCDKZGXDZTR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27214614

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

329.42

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

1.025

Distribution Coefficient, logD

0.893

Water Solubility, LogSw

-2.18

Polar Surface Area

45.009

Acid Dissociation Constant (pKa)

28.94

Base Dissociation Constant (pKb)

6.95

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

29.40

H025-0442C in Drug Discovery

Included in Screening Libraries

Soluble Diversity Library (15920 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with H025-0442C chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound H025-0442C?
Check Price and Availability of H025-0442C, 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 H025-0442C you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for H025-0442C
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for H025-0442C
  • 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 H025-0442C available by request