C769-1044 Screening compound: 3-(4-chlorobenzenesulfonyl)-6-ethyl-4-(4-ethylpiperazin-1-yl)quinoline

C769-1044 Screening compound: 3-(4-chlorobenzenesulfonyl)-6-ethyl-4-(4-ethylpiperazin-1-yl)quinoline
C769-1044 Screening compound: 3-(4-chlorobenzenesulfonyl)-6-ethyl-4-(4-ethylpiperazin-1-yl)quinoline alternative view

Chemical Structure Depiction of ChemDiv screening compound C769-1044
3-(4-chlorobenzenesulfonyl)-6-ethyl-4-(4-ethylpiperazin-1-yl)quinoline

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

C769-1044

Molecular Formula

C23H26ClN3O2S (C23 H26 ClN3 O2 S)

Compound Name

3-(4-chlorobenzenesulfonyl)-6-ethyl-4-(4-ethylpiperazin-1-yl)quinoline

IUPAC name

3-(4-chlorobenzenesulfonyl)-6-ethyl-4-(4-ethylpiperazin-1-yl)quinoline

SMILES

CCc(cc12)ccc2ncc(S(c(cc2)ccc2Cl)(=O)=O)c1N1CCN(CC)CC1

InChI

InChI=1S/C23H26ClN3O2S/c1-3-17-5-10-21-20(15-17)23(27-13-11-26(4-2)12-14-27)22(16-25-21)30(28,29)19-8-6-18(24)7-9-19/h5-10,15-16H,3-4,11-14H2,1-2H3

InChI Key

VYTOSSSQHPKUNE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14792750

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

444

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

4.989

Distribution Coefficient, logD

4.621

Water Solubility, LogSw

-4.96

Polar Surface Area

44.979

Acid Dissociation Constant (pKa)

24.35

Base Dissociation Constant (pKb)

7.52

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

34.80

C769-1044 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-infective Library (19449 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Ion Channels Focused Library (26372 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Nervous system
  • Cardiovascular
Targets:
  • Ion Channels

References: we are preparing a list of scientific research reports with C769-1044 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C769-1044?
Check Price and Availability of C769-1044, 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 C769-1044 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C769-1044
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C769-1044
  • 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 C769-1044 available by request