5408-2335 Screening compound: (4E)-4-({3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl}methylidene)-3-methyl-4,5-dihydro-1,2-oxazol-5-one

5408-2335 Screening compound: (4E)-4-({3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl}methylidene)-3-methyl-4,5-dihydro-1,2-oxazol-5-one
5408-2335 Screening compound: (4E)-4-({3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl}methylidene)-3-methyl-4,5-dihydro-1,2-oxazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 5408-2335
(4E)-4-({3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl}methylidene)-3-methyl-4,5-dihydro-1,2-oxazol-5-one

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

5408-2335

Molecular Formula

C20H18FNO4 (C20 H18 FNO4)

Compound Name

(4E)-4-({3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl}methylidene)-3-methyl-4,5-dihydro-1,2-oxazol-5-one

IUPAC name

(4E)-4-({3-ethoxy-4-[(2-fluorophenyl)methoxy]phenyl}methylidene)-3-methyl-45-dihydro-12-oxazol-5-one

SMILES

CCOc(cc(/C=C(\C(C)=NO1)/C1=O)cc1)c1OCc(cccc1)c1F

InChI

InChI=1S/C20H18FNO4/c1-3-24-19-11-14(10-16-13(2)22-26-20(16)23)8-9-18(19)25-12-15-6-4-5-7-17(15)21/h4-11H,3,12H2,1-2H3

InChI Key

KSVYPWJPODFWFB-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14710555

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

355.37

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

3.372

Distribution Coefficient, logD

3.372

Water Solubility, LogSw

-3.50

Polar Surface Area

49.661

Acid Dissociation Constant (pKa)

27.38

Base Dissociation Constant (pKb)

-4.15

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

20.00

5408-2335 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

Human Kinases Annotated Library (2415 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

References: we are preparing a list of scientific research reports with 5408-2335 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5408-2335?
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What is the minimum amount of 5408-2335 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5408-2335
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5408-2335
  • 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 5408-2335 available by request