8177-1819 Screening compound: 4-(4-methoxy-3-methylbenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one

8177-1819 Screening compound: 4-(4-methoxy-3-methylbenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one
8177-1819 Screening compound: 4-(4-methoxy-3-methylbenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8177-1819
4-(4-methoxy-3-methylbenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one

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

8177-1819

Molecular Formula

C16H16N2O4S (C16 H16 N2 O4 S)

Compound Name

4-(4-methoxy-3-methylbenzenesulfonyl)-1,2,3,4-tetrahydroquinoxalin-2-one

IUPAC name

4-(4-methoxy-3-methylbenzenesulfonyl)-1234-tetrahydroquinoxalin-2-one

SMILES

Cc(cc(cc1)S(N(C2)c(cccc3)c3NC2=O)(=O)=O)c1OC

InChI

InChI=1S/C16H16N2O4S/c1-11-9-12(7-8-15(11)22-2)23(20,21)18-10-16(19)17-13-5-3-4-6-14(13)18/h3-9H,10H2,1-2H3,(H,17,19)

InChI Key

PXIDWVNNVBMCKH-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07396141

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.38

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.398

Distribution Coefficient, logD

2.398

Water Solubility, LogSw

-2.95

Polar Surface Area

63.855

Acid Dissociation Constant (pKa)

11.13

Base Dissociation Constant (pKb)

-4.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

8177-1819 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Anti-Aging Library (44940 compounds)

Antimitotic Tubulin Library (17355 compounds)

Antiviral HBV Library (10007 compounds)

Antiviral Library (67538 compounds)

Dark Chemical Matter Library (18430 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
  • Pool
Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Antiviral
  • Infections
  • Immune system
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with 8177-1819 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8177-1819?
Check Price and Availability of 8177-1819, 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 8177-1819 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8177-1819
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8177-1819
  • 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 8177-1819 available by request