G672-0413 Screening compound: N-[(4-fluorophenyl)methyl]-2-[6-oxo-3-(piperidine-1-sulfonyl)-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]acetamide

G672-0413 Screening compound: N-[(4-fluorophenyl)methyl]-2-[6-oxo-3-(piperidine-1-sulfonyl)-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]acetamide
G672-0413 Screening compound: N-[(4-fluorophenyl)methyl]-2-[6-oxo-3-(piperidine-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 G672-0413
N-[(4-fluorophenyl)methyl]-2-[6-oxo-3-(piperidine-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

G672-0413

Molecular Formula

C26H31FN4O4S (C26 H31 FN4 O4 S)

Compound Name

N-[(4-fluorophenyl)methyl]-2-[6-oxo-3-(piperidine-1-sulfonyl)-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxalin-5-yl]acetamide

IUPAC name

N-[(4-fluorophenyl)methyl]-2-[6-oxo-3-(piperidine-1-sulfonyl)-5H6H6aH7H8H9H10H-pyrido[12-a]quinoxalin-5-yl]acetamide

SMILES

O=C(CN1c(cc(cc2)S(N3CCCCC3)(=O)=O)c2N(CCCC2)C2C1=O)NCc(cc1)ccc1F

MDL Number (MFCD)

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

514.62

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.988

Distribution Coefficient, logD

2.988

Water Solubility, LogSw

-3.53

Polar Surface Area

73.974

Acid Dissociation Constant (pKa)

12.58

Base Dissociation Constant (pKb)

-0.95

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

46.20

G672-0413 in Drug Discovery

Included in Screening Libraries

Antiviral Library (67538 compounds)

Lipid Metabolism Library (9174 compounds)

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with G672-0413 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G672-0413?
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What is the minimum amount of G672-0413 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G672-0413
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G672-0413
  • 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 G672-0413 available by request