F393-0063 Screening compound: 2-(6-chloro-2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)-N-{4-methyl-5-oxo-1H,2H,4H,5H-imidazo[1,2-a]quinazolin-7-yl}acetamide

F393-0063 Screening compound: 2-(6-chloro-2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)-N-{4-methyl-5-oxo-1H,2H,4H,5H-imidazo[1,2-a]quinazolin-7-yl}acetamide
F393-0063 Screening compound: 2-(6-chloro-2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)-N-{4-methyl-5-oxo-1H,2H,4H,5H-imidazo[1,2-a]quinazolin-7-yl}acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound F393-0063
2-(6-chloro-2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)-N-{4-methyl-5-oxo-1H,2H,4H,5H-imidazo[1,2-a]quinazolin-7-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

F393-0063

Molecular Formula

C23H22ClN5O4 (C23 H22 ClN5 O4)

Compound Name

2-(6-chloro-2-ethyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-4-yl)-N-{4-methyl-5-oxo-1H,2H,4H,5H-imidazo[1,2-a]quinazolin-7-yl}acetamide

IUPAC name

2-(6-chloro-2-ethyl-3-oxo-34-dihydro-2H-14-benzoxazin-4-yl)-N-{4-methyl-5-oxo-1H2H4H5H-imidazo[12-a]quinazolin-7-yl}acetamide

SMILES

CCC1Oc(ccc(Cl)c2)c2N(CC(Nc(cc2)cc(C(N3C)=O)c2N2C3=NCC2)=O)C1=O

InChI

InChI=1S/C23H22ClN5O4/c1-3-18-22(32)29(17-10-13(24)4-7-19(17)33-18)12-20(30)26-14-5-6-16-15(11-14)21(31)27(2)23-25-8-9-28(16)23/h4-7,10-11,18H,3,8-9,12H2,1-2H3,(H,26,30)/t18-/m1/s1

InChI Key

WXTJKSYJYWPJNX-GOSISDBHSA-N

MDL Number (MFCD)

MFCD27122266

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

467.91

Hydrogen Bond Acceptors Count

8.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

2.878

Distribution Coefficient, logD

2.457

Water Solubility, LogSw

-3.56

Polar Surface Area

75.484

Acid Dissociation Constant (pKa)

11.92

Base Dissociation Constant (pKb)

7.61

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

30.40

F393-0063 in Drug Discovery

Included in Screening Libraries

3D-Pharmacophore Based Diversity Library (49813 compounds)

Anti-infective Library (19449 compounds)

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

PPI Inhibitors Tripeptide Mimetics (23972 compounds)

Protein Arginine Methyltransferases Library (27925 compounds)

Protein-Protein Interaction Library (218420 compounds)

Targeted Diversity Library (40567 compounds)

Chemokine Receptor-Targeted Library (18382 compounds)

New Agro Library (44492 compounds)

Peptidomimetic Library (37031 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Metabolic
  • Immune system
Mechanism of action:
  • PPI modulators
  • Epigenetic
  • PPI modulators
  • Receptor's ligands
  • PPI modulators
Structure:
  • Mimetics
  • Mimetics
Targets:
  • Others
Agro:
  • Agro

References: we are preparing a list of scientific research reports with F393-0063 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F393-0063?
Check Price and Availability of F393-0063, 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 F393-0063 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F393-0063
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F393-0063
  • 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 F393-0063 available by request