4787-1833 Screening compound: 4-[4-(4-chlorobenzenesulfonyl)piperazin-1-yl]-2-methylquinoline

4787-1833 Screening compound: 4-[4-(4-chlorobenzenesulfonyl)piperazin-1-yl]-2-methylquinoline
4787-1833 Screening compound: 4-[4-(4-chlorobenzenesulfonyl)piperazin-1-yl]-2-methylquinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound 4787-1833
4-[4-(4-chlorobenzenesulfonyl)piperazin-1-yl]-2-methylquinoline

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

4787-1833

Molecular Formula

C20H20ClN3O2S (C20 H20 ClN3 O2 S)

Compound Name

4-[4-(4-chlorobenzenesulfonyl)piperazin-1-yl]-2-methylquinoline

IUPAC name

4-[4-(4-chlorobenzenesulfonyl)piperazin-1-yl]-2-methylquinoline

SMILES

Cc1nc2ccccc2c(N(CC2)CCN2S(c(cc2)ccc2Cl)(=O)=O)c1

InChI

InChI=1S/C20H20ClN3O2S/c1-15-14-20(18-4-2-3-5-19(18)22-15)23-10-12-24(13-11-23)27(25,26)17-8-6-16(21)7-9-17/h2-9,14H,10-13H2,1H3

InChI Key

ISKKHUSIKPRBKI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02180044

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

401.92

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.226

Distribution Coefficient, logD

2.166

Water Solubility, LogSw

-4.50

Polar Surface Area

43.046

Acid Dissociation Constant (pKa)

26.09

Base Dissociation Constant (pKb)

9.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

4787-1833 in Drug Discovery

Included in Screening Libraries

CNS targets activity set (6557 compounds)

GPCR Targeted Library (31838 compounds)

Human GPCR Annotated Library (5539 compounds)

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

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Musculoskeletal
  • Respiratory tract
  • Nervous system
  • Congenital
  • Skin
  • Metabolic
  • Endocrine
  • Nervous system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • GPCR
  • Ion Channels
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 4787-1833 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4787-1833?
Check Price and Availability of 4787-1833, 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 4787-1833 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4787-1833
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4787-1833
  • 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 4787-1833 available by request