7472-0202 Screening compound: 1-(4-phenylpiperazin-1-yl)-2-{[3-(piperidin-1-yl)quinoxalin-2-yl]sulfanyl}ethan-1-one

7472-0202 Screening compound: 1-(4-phenylpiperazin-1-yl)-2-{[3-(piperidin-1-yl)quinoxalin-2-yl]sulfanyl}ethan-1-one
7472-0202 Screening compound: 1-(4-phenylpiperazin-1-yl)-2-{[3-(piperidin-1-yl)quinoxalin-2-yl]sulfanyl}ethan-1-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 7472-0202
1-(4-phenylpiperazin-1-yl)-2-{[3-(piperidin-1-yl)quinoxalin-2-yl]sulfanyl}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

7472-0202

Molecular Formula

C25H29N5OS (C25 H29 N5 OS)

Compound Name

1-(4-phenylpiperazin-1-yl)-2-{[3-(piperidin-1-yl)quinoxalin-2-yl]sulfanyl}ethan-1-one

IUPAC name

1-(4-phenylpiperazin-1-yl)-2-{[3-(piperidin-1-yl)quinoxalin-2-yl]sulfanyl}ethan-1-one

SMILES

O=C(CSc1nc2ccccc2nc1N1CCCCC1)N(CC1)CCN1c1ccccc1

InChI

InChI=1S/C25H29N5OS/c31-23(29-17-15-28(16-18-29)20-9-3-1-4-10-20)19-32-25-24(30-13-7-2-8-14-30)26-21-11-5-6-12-22(21)27-25/h1,3-6,9-12H,2,7-8,13-19H2

InChI Key

LVGAVPXVRAZZMN-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14712703

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

447.6

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

4.990

Distribution Coefficient, logD

4.990

Water Solubility, LogSw

-4.73

Polar Surface Area

40.070

Acid Dissociation Constant (pKa)

21.57

Base Dissociation Constant (pKb)

5.55

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

40.00

7472-0202 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Voltage-Gated Ion Channel-Targeted Library (4740 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Nervous system
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with 7472-0202 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 7472-0202?
Check Price and Availability of 7472-0202, 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 7472-0202 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 7472-0202
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 7472-0202
  • 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 7472-0202 available by request