K076-0895 Screening compound: (4E)-2-(2-chlorophenyl)-4-[(naphthalen-1-yl)methylidene]-4,5-dihydro-1,3-oxazol-5-one

K076-0895 Screening compound: (4E)-2-(2-chlorophenyl)-4-[(naphthalen-1-yl)methylidene]-4,5-dihydro-1,3-oxazol-5-one
K076-0895 Screening compound: (4E)-2-(2-chlorophenyl)-4-[(naphthalen-1-yl)methylidene]-4,5-dihydro-1,3-oxazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K076-0895
(4E)-2-(2-chlorophenyl)-4-[(naphthalen-1-yl)methylidene]-4,5-dihydro-1,3-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

K076-0895

Molecular Formula

C20H12ClNO2 (C20 H12 ClNO2)

Compound Name

(4E)-2-(2-chlorophenyl)-4-[(naphthalen-1-yl)methylidene]-4,5-dihydro-1,3-oxazol-5-one

IUPAC name

(4E)-2-(2-chlorophenyl)-4-[(naphthalen-1-yl)methylidene]-45-dihydro-13-oxazol-5-one

SMILES

O=C1OC(c(cccc2)c2Cl)=N/C1=C/c1cccc2ccccc12

InChI

InChI=1S/C20H12ClNO2/c21-17-11-4-3-10-16(17)19-22-18(20(23)24-19)12-14-8-5-7-13-6-1-2-9-15(13)14/h1-12H

InChI Key

ODVHOXCNJFIRDW-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00968746

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

333.77

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.847

Distribution Coefficient, logD

4.847

Water Solubility, LogSw

-5.03

Polar Surface Area

30.104

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

0.42

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

K076-0895 in Drug Discovery

Included in Screening Libraries

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with K076-0895 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K076-0895?
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What is the minimum amount of K076-0895 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K076-0895
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K076-0895
  • 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 K076-0895 available by request