8014-0521 Screening compound: 4-(benzyloxy)-3-ethoxybenzaldehyde

8014-0521 Screening compound: 4-(benzyloxy)-3-ethoxybenzaldehyde
8014-0521 Screening compound: 4-(benzyloxy)-3-ethoxybenzaldehyde alternative view

Chemical Structure Depiction of ChemDiv screening compound 8014-0521
4-(benzyloxy)-3-ethoxybenzaldehyde

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

8014-0521

Molecular Formula

C16H16O3 (C16 H16 O3)

Compound Name

4-(benzyloxy)-3-ethoxybenzaldehyde

IUPAC name

4-(benzyloxy)-3-ethoxybenzaldehyde

SMILES

CCOc(cc(C=O)cc1)c1OCc1ccccc1

InChI

InChI=1S/C16H16O3/c1-2-18-16-10-14(11-17)8-9-15(16)19-12-13-6-4-3-5-7-13/h3-11H,2,12H2,1H3

InChI Key

NCOFQZRLIYPMNJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00615145

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

256.3

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

2.966

Distribution Coefficient, logD

2.966

Water Solubility, LogSw

-3.06

Polar Surface Area

28.922

Acid Dissociation Constant (pKa)

29.40

Base Dissociation Constant (pKb)

0.00

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.75

8014-0521 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

?ysteine Targeted Covalent Library (39471 compounds)

Receptor-type Protein Tyrosine Phosphatases Library (3746 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic
  • Cancer
  • Digestive system
  • Nervous system
  • Female
  • Metabolic
  • Endocrine
Targets:
  • Phosphatases
Mechanism of action:
  • Receptor's ligands

References: we are preparing a list of scientific research reports with 8014-0521 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8014-0521?
Check Price and Availability of 8014-0521, 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 8014-0521 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8014-0521
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8014-0521
  • 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 8014-0521 available by request