K076-0671 Screening compound: (4Z)-2-(4-bromophenyl)-4-[(thiophen-2-yl)methylidene]-4,5-dihydro-1,3-oxazol-5-one

K076-0671 Screening compound: (4Z)-2-(4-bromophenyl)-4-[(thiophen-2-yl)methylidene]-4,5-dihydro-1,3-oxazol-5-one
K076-0671 Screening compound: (4Z)-2-(4-bromophenyl)-4-[(thiophen-2-yl)methylidene]-4,5-dihydro-1,3-oxazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K076-0671
(4Z)-2-(4-bromophenyl)-4-[(thiophen-2-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

K076-0671

Molecular Formula

C14H8BrNO2S (C14 H8 BrNO2 S)

Compound Name

(4Z)-2-(4-bromophenyl)-4-[(thiophen-2-yl)methylidene]-4,5-dihydro-1,3-oxazol-5-one

IUPAC name

(4Z)-2-(4-bromophenyl)-4-[(thiophen-2-yl)methylidene]-45-dihydro-13-oxazol-5-one

SMILES

O=C1OC(c(cc2)ccc2Br)=N/C1=C\c1cccs1

InChI

InChI=1S/C14H8BrNO2S/c15-10-5-3-9(4-6-10)13-16-12(14(17)18-13)8-11-2-1-7-19-11/h1-8H

InChI Key

GJIOIUJOJXFMJC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01012165

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

334.19

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

3.760

Distribution Coefficient, logD

3.760

Water Solubility, LogSw

-4.23

Polar Surface Area

31.394

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

0.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

K076-0671 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

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 K076-0671 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K076-0671?
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What is the minimum amount of K076-0671 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K076-0671
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K076-0671
  • 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 K076-0671 available by request