C279-0878 Screening compound: N-[2-(5,8-dimethyl-2-oxo-1,2-dihydro-3-quinolinyl)ethyl]-4-fluoro-1-benzenesulfonamide

C279-0878 Screening compound: N-[2-(5,8-dimethyl-2-oxo-1,2-dihydro-3-quinolinyl)ethyl]-4-fluoro-1-benzenesulfonamide
C279-0878 Screening compound: N-[2-(5,8-dimethyl-2-oxo-1,2-dihydro-3-quinolinyl)ethyl]-4-fluoro-1-benzenesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C279-0878
N-[2-(5,8-dimethyl-2-oxo-1,2-dihydro-3-quinolinyl)ethyl]-4-fluoro-1-benzenesulfonamide

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

C279-0878

Molecular Formula

C19H19FN2O3S (C19 H19 FN2 O3 S)

Compound Name

N-[2-(5,8-dimethyl-2-oxo-1,2-dihydro-3-quinolinyl)ethyl]-4-fluoro-1-benzenesulfonamide

IUPAC name

N-[2-(58-dimethyl-2-oxo-12-dihydroquinolin-3-yl)ethyl]-4-fluorobenzene-1-sulfonamide

SMILES

Cc1ccc(C)c(N2)c1C=C(CCNS(c(cc1)ccc1F)(=O)=O)C2=O

InChI

InChI=1S/C19H19FN2O3S/c1-12-3-4-13(2)18-17(12)11-14(19(23)22-18)9-10-21-26(24,25)16-7-5-15(20)6-8-16/h3-8,11,21H,9-10H2,1-2H3,(H,22,23)

InChI Key

ZGZSCMRLEOETFA-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04463015

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

374.44

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.392

Distribution Coefficient, logD

3.392

Water Solubility, LogSw

-3.79

Polar Surface Area

64.464

Acid Dissociation Constant (pKa)

11.13

Base Dissociation Constant (pKb)

-1.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.05

C279-0878 in Drug Discovery

Included in Screening Libraries

Anticancer Library (62698 compounds)

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with C279-0878 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C279-0878?
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What is the minimum amount of C279-0878 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C279-0878
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C279-0878
  • 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 C279-0878 available by request