S358-0243 Screening compound: 3-(3-ethoxyphenyl)-5-[6-(4-fluorophenyl)-5H,6H,8H-imidazo[4,3-c][1,4]oxazin-1-yl]-1,2,4-oxadiazole

S358-0243 Screening compound: 3-(3-ethoxyphenyl)-5-[6-(4-fluorophenyl)-5H,6H,8H-imidazo[4,3-c][1,4]oxazin-1-yl]-1,2,4-oxadiazole
S358-0243 Screening compound: 3-(3-ethoxyphenyl)-5-[6-(4-fluorophenyl)-5H,6H,8H-imidazo[4,3-c][1,4]oxazin-1-yl]-1,2,4-oxadiazole alternative view

Chemical Structure Depiction of ChemDiv screening compound S358-0243
3-(3-ethoxyphenyl)-5-[6-(4-fluorophenyl)-5H,6H,8H-imidazo[4,3-c][1,4]oxazin-1-yl]-1,2,4-oxadiazole

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

S358-0243

Molecular Formula

C22H19FN4O3 (C22 H19 FN4 O3)

Compound Name

3-(3-ethoxyphenyl)-5-[6-(4-fluorophenyl)-5H,6H,8H-imidazo[4,3-c][1,4]oxazin-1-yl]-1,2,4-oxadiazole

IUPAC name

3-(3-ethoxyphenyl)-5-[6-(4-fluorophenyl)-5H6H8H-imidazo[43-c][14]oxazin-1-yl]-124-oxadiazole

SMILES

CCOc1cccc(-c2noc(-c3c(COC(C4)c(cc5)ccc5F)n4cn3)n2)c1

InChI

InChI=1S/C22H19FN4O3/c1-2-28-17-5-3-4-15(10-17)21-25-22(30-26-21)20-18-12-29-19(11-27(18)13-24-20)14-6-8-16(23)9-7-14/h3-10,13,19H,2,11-12H2,1H3/t19-/m0/s1

InChI Key

PFMCFJRXMSCPRC-IBGZPJMESA-N

MDL Number (MFCD)

MFCD29032687

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

406.42

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.954

Distribution Coefficient, logD

3.954

Water Solubility, LogSw

-4.03

Polar Surface Area

58.451

Acid Dissociation Constant (pKa)

22.38

Base Dissociation Constant (pKb)

0.59

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

22.70

S358-0243 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

PPI Helix Turn 3D-Mimetics Library (71298 compounds)

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
Mechanism of action:
  • PPI modulators
  • PPI modulators
Structure:
  • Mimetics
  • Cyclic compounds

References: we are preparing a list of scientific research reports with S358-0243 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound S358-0243?
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What is the minimum amount of S358-0243 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for S358-0243
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for S358-0243
  • 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 S358-0243 available by request