G672-0248 Screening compound: N-benzyl-N-methyl-2-[6-oxo-3-(pyrrolidine-1-sulfonyl)-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]acetamide

G672-0248 Screening compound: N-benzyl-N-methyl-2-[6-oxo-3-(pyrrolidine-1-sulfonyl)-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]acetamide
G672-0248 Screening compound: N-benzyl-N-methyl-2-[6-oxo-3-(pyrrolidine-1-sulfonyl)-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G672-0248
N-benzyl-N-methyl-2-[6-oxo-3-(pyrrolidine-1-sulfonyl)-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]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

G672-0248

Molecular Formula

C26H32N4O4S (C26 H32 N4 O4 S)

Compound Name

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

IUPAC name

N-benzyl-N-methyl-2-[6-oxo-3-(pyrrolidine-1-sulfonyl)-5H6H6aH7H8H9H10H-pyrido[12-a]quinoxalin-5-yl]acetamide

SMILES

CN(Cc1ccccc1)C(CN1c(cc(cc2)S(N3CCCC3)(=O)=O)c2N(CCCC2)C2C1=O)=O

InChI

InChI=1S/C26H32N4O4S/c1-27(18-20-9-3-2-4-10-20)25(31)19-30-24-17-21(35(33,34)28-14-7-8-15-28)12-13-22(24)29-16-6-5-11-23(29)26(30)32/h2-4,9-10,12-13,17,23H,5-8,11,14-16,18-19H2,1H3/t23-/m1/s1

InChI Key

JTCUYZIIBZOQQV-HSZRJFAPSA-N

MDL Number (MFCD)

MFCD27150347

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

496.63

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.970

Distribution Coefficient, logD

2.970

Water Solubility, LogSw

-3.55

Polar Surface Area

65.763

Acid Dissociation Constant (pKa)

15.09

Base Dissociation Constant (pKb)

-0.32

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.20

G672-0248 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 G672-0248 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G672-0248?
Check Price and Availability of G672-0248, 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 G672-0248 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G672-0248
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G672-0248
  • 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 G672-0248 available by request