G672-0026 Screening compound: 2-[3-(dimethylsulfamoyl)-6-oxo-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]-N-[(pyridin-2-yl)methyl]acetamide

G672-0026 Screening compound: 2-[3-(dimethylsulfamoyl)-6-oxo-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]-N-[(pyridin-2-yl)methyl]acetamide
G672-0026 Screening compound: 2-[3-(dimethylsulfamoyl)-6-oxo-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]-N-[(pyridin-2-yl)methyl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G672-0026
2-[3-(dimethylsulfamoyl)-6-oxo-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]-N-[(pyridin-2-yl)methyl]acetamide

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

G672-0026

Molecular Formula

C22H27N5O4S (C22 H27 N5 O4 S)

Compound Name

2-[3-(dimethylsulfamoyl)-6-oxo-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]-N-[(pyridin-2-yl)methyl]acetamide

IUPAC name

2-[3-(dimethylsulfamoyl)-6-oxo-5H6H6aH7H8H9H10H-pyrido[12-a]quinoxalin-5-yl]-N-[(pyridin-2-yl)methyl]acetamide

SMILES

CN(C)S(c(cc1)cc(N2CC(NCc3ncccc3)=O)c1N(CCCC1)C1C2=O)(=O)=O

InChI

InChI=1S/C22H27N5O4S/c1-25(2)32(30,31)17-9-10-18-20(13-17)27(22(29)19-8-4-6-12-26(18)19)15-21(28)24-14-16-7-3-5-11-23-16/h3,5,7,9-11,13,19H,4,6,8,12,14-15H2,1-2H3,(H,24,28)/t19-/m1/s1

InChI Key

XORDCXBXGLSWEW-LJQANCHMSA-N

MDL Number (MFCD)

MFCD27150239

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

457.55

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

1.289

Distribution Coefficient, logD

1.288

Water Solubility, LogSw

-2.69

Polar Surface Area

85.470

Acid Dissociation Constant (pKa)

12.80

Base Dissociation Constant (pKb)

4.74

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.90

G672-0026 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with G672-0026 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G672-0026?
Check Price and Availability of G672-0026, 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 G672-0026 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G672-0026
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G672-0026
  • 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 G672-0026 available by request