V003-5054 Screening compound: 2-(3-ethoxyphenyl)-5-methyl-1,3-benzoxazole

V003-5054 Screening compound: 2-(3-ethoxyphenyl)-5-methyl-1,3-benzoxazole
V003-5054 Screening compound: 2-(3-ethoxyphenyl)-5-methyl-1,3-benzoxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V003-5054
2-(3-ethoxyphenyl)-5-methyl-1,3-benzoxazole

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

V003-5054

Molecular Formula

C16H15NO2 (C16 H15 NO2)

Compound Name

2-(3-ethoxyphenyl)-5-methyl-1,3-benzoxazole

IUPAC name

2-(3-ethoxyphenyl)-5-methyl-13-benzoxazole

SMILES

CCOc1cccc(-c2nc(cc(C)cc3)c3o2)c1

InChI

InChI=1S/C16H15NO2/c1-3-18-13-6-4-5-12(10-13)16-17-14-9-11(2)7-8-15(14)19-16/h4-10H,3H2,1-2H3

InChI Key

DQAQXCOVZZTSKJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02031844

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

253.3

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.315

Distribution Coefficient, logD

4.315

Water Solubility, LogSw

-4.38

Polar Surface Area

24.172

Acid Dissociation Constant (pKa)

28.01

Base Dissociation Constant (pKb)

0.36

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

V003-5054 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiviral Annotated Library (21441 compounds)

Selective Target Activity Profiling Library (14702 compounds)

Serine Proteases Inhibitors Library (32732 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Cardiovascular
  • Skin
  • Metabolic
  • Immune system
Mechanism of action:
  • Epigenetic
Targets:
  • Proteases

References: we are preparing a list of scientific research reports with V003-5054 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V003-5054?
Check Price and Availability of V003-5054, 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 V003-5054 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V003-5054
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V003-5054
  • 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 V003-5054 available by request