0557-0497 Screening compound: 1-[2-(4-benzamidophenyl)-2-oxoethyl]quinolin-1-ium

0557-0497 Screening compound: 1-[2-(4-benzamidophenyl)-2-oxoethyl]quinolin-1-ium
0557-0497 Screening compound: 1-[2-(4-benzamidophenyl)-2-oxoethyl]quinolin-1-ium alternative view

Chemical Structure Depiction of ChemDiv screening compound 0557-0497
1-[2-(4-benzamidophenyl)-2-oxoethyl]quinolin-1-ium

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

0557-0497

Molecular Formula

C24H19N2O2 (C24 H19 N2 O2)

Compound Name

1-[2-(4-benzamidophenyl)-2-oxoethyl]quinolin-1-ium

IUPAC name

1-[2-(4-benzamidophenyl)-2-oxoethyl]quinolin-1-ium

SMILES

O=C(C[n+]1cccc2ccccc12)c(cc1)ccc1NC(c1ccccc1)=O

InChI

InChI=1S/C24H18N2O2/c27-23(17-26-16-6-10-18-7-4-5-11-22(18)26)19-12-14-21(15-13-19)25-24(28)20-8-2-1-3-9-20/h1-16H,17H2/p+1

InChI Key

GSWCLSQMZNEKMR-UHFFFAOYSA-O

MDL Number (MFCD)

MFCD00989085

Chemical and Physical Properties

Saltdata

Br-

Molecular Weight

367.43

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

3.836

Distribution Coefficient, logD

3.828

Water Solubility, LogSw

-3.93

Polar Surface Area

37.397

Acid Dissociation Constant (pKa)

9.12

Base Dissociation Constant (pKb)

-3.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.20

0557-0497 in Drug Discovery

Included in Screening Libraries

Cardiovascular Library (22201 compounds)

Human Kinases Annotated Library (2415 compounds)

Antibacterial Compounds Library (13827 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with 0557-0497 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 0557-0497?
Check Price and Availability of 0557-0497, 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 0557-0497 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 0557-0497
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 0557-0497
  • 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 0557-0497 available by request