4100-3752 Screening compound: 2-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide

4100-3752 Screening compound: 2-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide
4100-3752 Screening compound: 2-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 4100-3752
2-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide

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

4100-3752

Molecular Formula

C24H21N3O3S (C24 H21 N3 O3 S)

Compound Name

2-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide

IUPAC name

2-phenyl-N-[2-(4-sulfamoylphenyl)ethyl]quinoline-4-carboxamide

SMILES

NS(c1ccc(CCNC(c2cc(-c3ccccc3)nc3ccccc23)=O)cc1)(=O)=O

InChI

InChI=1S/C24H21N3O3S/c25-31(29,30)19-12-10-17(11-13-19)14-15-26-24(28)21-16-23(18-6-2-1-3-7-18)27-22-9-5-4-8-20(21)22/h1-13,16H,14-15H2,(H,26,28)(H2,25,29,30)

InChI Key

OIPKGCISCIBPRZ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02736107

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

431.52

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.708

Distribution Coefficient, logD

3.707

Water Solubility, LogSw

-4.30

Polar Surface Area

83.156

Acid Dissociation Constant (pKa)

10.18

Base Dissociation Constant (pKb)

3.40

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

8.30

4100-3752 in Drug Discovery

Included in Screening Libraries

Autophagy-Targeted Library (4564 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Carbonic Anhydrase II Library (4939 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Cancer
  • Digestive system
  • Respiratory tract
  • Nervous system
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system

References: we are preparing a list of scientific research reports with 4100-3752 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 4100-3752?
Check Price and Availability of 4100-3752, 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 4100-3752 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 4100-3752
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 4100-3752
  • 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 4100-3752 available by request