5408-2266 Screening compound: (4E)-4-[(5-chloro-2-methoxyphenyl)methylidene]-3-methyl-4,5-dihydro-1,2-oxazol-5-one

5408-2266 Screening compound: (4E)-4-[(5-chloro-2-methoxyphenyl)methylidene]-3-methyl-4,5-dihydro-1,2-oxazol-5-one
5408-2266 Screening compound: (4E)-4-[(5-chloro-2-methoxyphenyl)methylidene]-3-methyl-4,5-dihydro-1,2-oxazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 5408-2266
(4E)-4-[(5-chloro-2-methoxyphenyl)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

5408-2266

Molecular Formula

C12H10ClNO3 (C12 H10 ClNO3)

Compound Name

(4E)-4-[(5-chloro-2-methoxyphenyl)methylidene]-3-methyl-4,5-dihydro-1,2-oxazol-5-one

IUPAC name

n/a

SMILES

CC(/C1=C\c(cc(cc2)Cl)c2OC)=NOC1=O

InChI

InChI=1S/C12H10ClNO3/c1-7-10(12(15)17-14-7)6-8-5-9(13)3-4-11(8)16-2/h3-6H,1-2H3

InChI Key

CCKFUZIXXGQHCJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05031064

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

251.67

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.679

Distribution Coefficient, logD

2.679

Water Solubility, LogSw

-3.34

Polar Surface Area

42.766

Acid Dissociation Constant (pKa)

27.38

Base Dissociation Constant (pKb)

-4.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

5408-2266 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro
Structure:
  • Pool

References: we are preparing a list of scientific research reports with 5408-2266 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5408-2266?
Check Price and Availability of 5408-2266, 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 5408-2266 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5408-2266
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5408-2266
  • 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 5408-2266 available by request