C279-0881 Screening compound: N-[2-(5,8-dimethyl-2-oxo-1,2-dihydroquinolin-3-yl)ethyl]-2,4,6-trimethylbenzene-1-sulfonamide

C279-0881 Screening compound: N-[2-(5,8-dimethyl-2-oxo-1,2-dihydroquinolin-3-yl)ethyl]-2,4,6-trimethylbenzene-1-sulfonamide
C279-0881 Screening compound: N-[2-(5,8-dimethyl-2-oxo-1,2-dihydroquinolin-3-yl)ethyl]-2,4,6-trimethylbenzene-1-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C279-0881
N-[2-(5,8-dimethyl-2-oxo-1,2-dihydroquinolin-3-yl)ethyl]-2,4,6-trimethylbenzene-1-sulfonamide

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

C279-0881

Molecular Formula

C22H26N2O3S (C22 H26 N2 O3 S)

Compound Name

N-[2-(5,8-dimethyl-2-oxo-1,2-dihydroquinolin-3-yl)ethyl]-2,4,6-trimethylbenzene-1-sulfonamide

IUPAC name

N-[2-(58-dimethyl-2-oxo-12-dihydroquinolin-3-yl)ethyl]-246-trimethylbenzene-1-sulfonamide

SMILES

Cc(cc1C)cc(C)c1S(NCCC1=Cc(c(C)ccc2C)c2NC1=O)(=O)=O

InChI

InChI=1S/C22H26N2O3S/c1-13-10-16(4)21(17(5)11-13)28(26,27)23-9-8-18-12-19-14(2)6-7-15(3)20(19)24-22(18)25/h6-7,10-12,23H,8-9H2,1-5H3,(H,24,25)

InChI Key

SOQQYRUSZCYNAK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04463018

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

398.53

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

4.582

Distribution Coefficient, logD

4.581

Water Solubility, LogSw

-4.30

Polar Surface Area

64.464

Acid Dissociation Constant (pKa)

10.49

Base Dissociation Constant (pKb)

-1.80

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

C279-0881 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Glucocorticoid receptors Library (4806 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Cancer
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
  • Endocrine
Targets:
  • Nuclear receptors
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with C279-0881 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C279-0881?
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What is the minimum amount of C279-0881 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C279-0881
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C279-0881
  • 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 C279-0881 available by request