F393-0049 Screening compound: 3,4-diethoxy-N-{4-methyl-5-oxo-1H,2H,4H,5H-imidazo[1,2-a]quinazolin-7-yl}benzamide

F393-0049 Screening compound: 3,4-diethoxy-N-{4-methyl-5-oxo-1H,2H,4H,5H-imidazo[1,2-a]quinazolin-7-yl}benzamide
F393-0049 Screening compound: 3,4-diethoxy-N-{4-methyl-5-oxo-1H,2H,4H,5H-imidazo[1,2-a]quinazolin-7-yl}benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F393-0049
3,4-diethoxy-N-{4-methyl-5-oxo-1H,2H,4H,5H-imidazo[1,2-a]quinazolin-7-yl}benzamide

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

F393-0049

Molecular Formula

C22H24N4O4 (C22 H24 N4 O4)

Compound Name

3,4-diethoxy-N-{4-methyl-5-oxo-1H,2H,4H,5H-imidazo[1,2-a]quinazolin-7-yl}benzamide

IUPAC name

34-diethoxy-N-{4-methyl-5-oxo-1H2H4H5H-imidazo[12-a]quinazolin-7-yl}benzamide

SMILES

CCOc(ccc(C(Nc(cc1)cc(C(N2C)=O)c1N1C2=NCC1)=O)c1)c1OCC

InChI

InChI=1S/C22H24N4O4/c1-4-29-18-9-6-14(12-19(18)30-5-2)20(27)24-15-7-8-17-16(13-15)21(28)25(3)22-23-10-11-26(17)22/h6-9,12-13H,4-5,10-11H2,1-3H3,(H,24,27)

InChI Key

YGRADARYTXRKIM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14953789

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

408.46

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

8

Partition Coefficient, logP

2.165

Distribution Coefficient, logD

1.744

Water Solubility, LogSw

-3.09

Polar Surface Area

66.819

Acid Dissociation Constant (pKa)

11.54

Base Dissociation Constant (pKb)

7.61

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

F393-0049 in Drug Discovery

Included in Screening Libraries

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

Protein-Protein Interaction Library (218420 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
  • Receptor's ligands
Therapeutical areas:
  • Immune system

References: we are preparing a list of scientific research reports with F393-0049 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F393-0049?
Check Price and Availability of F393-0049, 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 F393-0049 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F393-0049
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F393-0049
  • 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 F393-0049 available by request