G587-0484 Screening compound: N-[(3-methoxyphenyl)methyl]-5-methyl-6-oxo-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxaline-3-carboxamide

G587-0484 Screening compound: N-[(3-methoxyphenyl)methyl]-5-methyl-6-oxo-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxaline-3-carboxamide
G587-0484 Screening compound: N-[(3-methoxyphenyl)methyl]-5-methyl-6-oxo-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxaline-3-carboxamide alternative view

Chemical Structure Depiction of ChemDiv screening compound G587-0484
N-[(3-methoxyphenyl)methyl]-5-methyl-6-oxo-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxaline-3-carboxamide

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

G587-0484

Molecular Formula

C22H25N3O3 (C22 H25 N3 O3)

Compound Name

N-[(3-methoxyphenyl)methyl]-5-methyl-6-oxo-5H,6H,6aH,7H,8H,9H,10H-pyrido[1,2-a]quinoxaline-3-carboxamide

IUPAC name

N-[(3-methoxyphenyl)methyl]-5-methyl-6-oxo-5H6H6aH7H8H9H10H-pyrido[12-a]quinoxaline-3-carboxamide

SMILES

CN1c(cc(cc2)C(NCc3cc(OC)ccc3)=O)c2N(CCCC2)C2C1=O

InChI

InChI=1S/C22H25N3O3/c1-24-20-13-16(21(26)23-14-15-6-5-7-17(12-15)28-2)9-10-18(20)25-11-4-3-8-19(25)22(24)27/h5-7,9-10,12-13,19H,3-4,8,11,14H2,1-2H3,(H,23,26)/t19-/m0/s1

InChI Key

XUGVUZKHQJNJKF-IBGZPJMESA-N

MDL Number (MFCD)

MFCD15021427

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

379.46

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

2.415

Distribution Coefficient, logD

2.415

Water Solubility, LogSw

-2.82

Polar Surface Area

49.786

Acid Dissociation Constant (pKa)

12.67

Base Dissociation Constant (pKb)

4.74

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

36.40

G587-0484 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

Protein-Protein Interaction Library (218420 compounds)

STING Agonist Library (5895 compounds)

SmartTM Library (51161 compounds)

Beyond the Flatland Library sp3 enriched (92988 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
  • Cyclic compounds
Mechanism of action:
  • PPI modulators
Therapeutical areas:
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with G587-0484 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound G587-0484?
Check Price and Availability of G587-0484, 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 G587-0484 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for G587-0484
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for G587-0484
  • 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 G587-0484 available by request