5683-0435 Screening compound: 2-[(1E)-2-PHENYLETHENYL]-4H-BENZO[H]CHROMEN-4-ONE

5683-0435 Screening compound: 2-[(1E)-2-PHENYLETHENYL]-4H-BENZO[H]CHROMEN-4-ONE
5683-0435 Screening compound: 2-[(1E)-2-PHENYLETHENYL]-4H-BENZO[H]CHROMEN-4-ONE alternative view

Chemical Structure Depiction of ChemDiv screening compound 5683-0435
2-[(1E)-2-PHENYLETHENYL]-4H-BENZO[H]CHROMEN-4-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

5683-0435

Molecular Formula

C21H14O2 (C21 H14 O2)

Compound Name

2-[(1E)-2-PHENYLETHENYL]-4H-BENZO[H]CHROMEN-4-ONE

IUPAC name

n/a

SMILES

O=C1c(ccc2ccccc22)c2OC(/C=C/c2ccccc2)=C1

InChI

InChI=1S/C21H14O2/c22-20-14-17(12-10-15-6-2-1-3-7-15)23-21-18-9-5-4-8-16(18)11-13-19(20)21/h1-14H

InChI Key

QTUBLJQKQPSHAO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD04062500

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

298.34

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

5.103

Distribution Coefficient, logD

5.103

Water Solubility, LogSw

-6.15

Polar Surface Area

21.440

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

5683-0435 in Drug Discovery

Included in Screening Libraries

Anti-infective Library (19449 compounds)

Antiviral Annotated Library (21441 compounds)

STING Agonist Library (5895 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Immune system
Targets:
  • Others

References: we are preparing a list of scientific research reports with 5683-0435 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 5683-0435?
Check Price and Availability of 5683-0435, 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 5683-0435 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 5683-0435
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 5683-0435
  • 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 5683-0435 available by request