C224-0838 Screening compound: N~6~-[3-(methylsulfanyl)phenyl]-2,3-dioxo-1,2,3,4-tetrahydro-6-quinoxalinesulfonamide

C224-0838 Screening compound: N~6~-[3-(methylsulfanyl)phenyl]-2,3-dioxo-1,2,3,4-tetrahydro-6-quinoxalinesulfonamide
C224-0838 Screening compound: N~6~-[3-(methylsulfanyl)phenyl]-2,3-dioxo-1,2,3,4-tetrahydro-6-quinoxalinesulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound C224-0838
N~6~-[3-(methylsulfanyl)phenyl]-2,3-dioxo-1,2,3,4-tetrahydro-6-quinoxalinesulfonamide

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

C224-0838

Molecular Formula

C15H13N3O4S2 (C15 H13 N3 O4 S2)

Compound Name

N~6~-[3-(methylsulfanyl)phenyl]-2,3-dioxo-1,2,3,4-tetrahydro-6-quinoxalinesulfonamide

IUPAC name

n/a

SMILES

CSc1cccc(NS(c(cc2)cc(NC3=O)c2NC3=O)(=O)=O)c1

InChI

InChI=1S/C15H13N3O4S2/c1-23-10-4-2-3-9(7-10)18-24(21,22)11-5-6-12-13(8-11)17-15(20)14(19)16-12/h2-8,18H,1H3,(H,16,19)(H,17,20)

InChI Key

MFNCNRFTHRGXMX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05027192

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

363.42

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

3.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

1.592

Distribution Coefficient, logD

1.074

Water Solubility, LogSw

-2.42

Polar Surface Area

90.723

Acid Dissociation Constant (pKa)

7.04

Base Dissociation Constant (pKb)

-3.34

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

6.70

C224-0838 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Antiviral Library (67538 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Antiviral
  • Infections
  • Immune system

References: we are preparing a list of scientific research reports with C224-0838 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C224-0838?
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What is the minimum amount of C224-0838 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C224-0838
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C224-0838
  • 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 C224-0838 available by request