G672-0166 Screening compound: N-benzyl-2-[3-(diethylsulfamoyl)-6-oxo-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]-N-methylacetamide

G672-0166 Screening compound: N-benzyl-2-[3-(diethylsulfamoyl)-6-oxo-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]-N-methylacetamide
G672-0166 Screening compound: N-benzyl-2-[3-(diethylsulfamoyl)-6-oxo-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]-N-methylacetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G672-0166
N-benzyl-2-[3-(diethylsulfamoyl)-6-oxo-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]-N-methylacetamide

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

G672-0166

Molecular Formula

C26H34N4O4S (C26 H34 N4 O4 S)

Compound Name

N-benzyl-2-[3-(diethylsulfamoyl)-6-oxo-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]-N-methylacetamide

IUPAC name

N-benzyl-2-[3-(diethylsulfamoyl)-6-oxo-5H6H6aH7H8H9H10H-pyrido[12-a]quinoxalin-5-yl]-N-methylacetamide

SMILES

CCN(CC)S(c(cc1)cc(N2CC(N(C)Cc3ccccc3)=O)c1N(CCCC1)C1C2=O)(=O)=O

InChI

InChI=1S/C26H34N4O4S/c1-4-28(5-2)35(33,34)21-14-15-22-24(17-21)30(26(32)23-13-9-10-16-29(22)23)19-25(31)27(3)18-20-11-7-6-8-12-20/h6-8,11-12,14-15,17,23H,4-5,9-10,13,16,18-19H2,1-3H3/t23-/m1/s1

InChI Key

KRLDZIOWTUXFNE-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD27150317

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

498.65

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

3.127

Distribution Coefficient, logD

3.127

Water Solubility, LogSw

-3.49

Polar Surface Area

64.783

Acid Dissociation Constant (pKa)

15.09

Base Dissociation Constant (pKb)

-0.32

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.20

G672-0166 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

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

Nonpeptide Peptidomimetics PPI Library (18997 compounds)

Protein-Protein Interaction Library (218420 compounds)

SmartTM Library (51161 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Antiviral
  • Infections
  • Immune system
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics

References: we are preparing a list of scientific research reports with G672-0166 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G672-0166?
Check Price and Availability of G672-0166, 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 G672-0166 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G672-0166
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G672-0166
  • 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 G672-0166 available by request