K076-0499 Screening compound: (4E)-2-(3-bromophenyl)-4-[(naphthalen-1-yl)methylidene]-4,5-dihydro-1,3-oxazol-5-one

K076-0499 Screening compound: (4E)-2-(3-bromophenyl)-4-[(naphthalen-1-yl)methylidene]-4,5-dihydro-1,3-oxazol-5-one
K076-0499 Screening compound: (4E)-2-(3-bromophenyl)-4-[(naphthalen-1-yl)methylidene]-4,5-dihydro-1,3-oxazol-5-one alternative view

Chemical Structure Depiction of ChemDiv screening compound K076-0499
(4E)-2-(3-bromophenyl)-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

K076-0499

Molecular Formula

C20H12BrNO2 (C20 H12 BrNO2)

Compound Name

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

IUPAC name

(4E)-2-(3-bromophenyl)-4-[(naphthalen-1-yl)methylidene]-45-dihydro-13-oxazol-5-one

SMILES

O=C1OC(c2cccc(Br)c2)=N/C1=C/c1cccc2ccccc12

InChI

InChI=1S/C20H12BrNO2/c21-16-9-4-8-15(11-16)19-22-18(20(23)24-19)12-14-7-3-6-13-5-1-2-10-17(13)14/h1-12H

InChI Key

CFQASHQPKQEKFK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01538850

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

378.22

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

5.257

Distribution Coefficient, logD

5.257

Water Solubility, LogSw

-6.48

Polar Surface Area

30.104

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

0.62

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

References: we are preparing a list of scientific research reports with K076-0499 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K076-0499?
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What is the minimum amount of K076-0499 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K076-0499
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K076-0499
  • 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 K076-0499 available by request