V005-6986 Screening compound: 2-(2-ethylphenyl)-5-methyl-1,3-benzoxazole

V005-6986 Screening compound: 2-(2-ethylphenyl)-5-methyl-1,3-benzoxazole
V005-6986 Screening compound: 2-(2-ethylphenyl)-5-methyl-1,3-benzoxazole alternative view

Chemical Structure Depiction of ChemDiv screening compound V005-6986
2-(2-ethylphenyl)-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

V005-6986

Molecular Formula

C16H15NO (C16 H15 NO)

Compound Name

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

IUPAC name

2-(2-ethylphenyl)-5-methyl-13-benzoxazole

SMILES

CCc(cccc1)c1-c1nc(cc(C)cc2)c2o1

InChI

InChI=1S/C16H15NO/c1-3-12-6-4-5-7-13(12)16-17-14-10-11(2)8-9-15(14)18-16/h4-10H,3H2,1-2H3

InChI Key

OBXAZCKELXAURC-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19951326

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

237.3

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

2

Partition Coefficient, logP

4.630

Distribution Coefficient, logD

4.630

Water Solubility, LogSw

-4.49

Polar Surface Area

17.049

Acid Dissociation Constant (pKa)

26.31

Base Dissociation Constant (pKb)

-1.78

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

18.80

V005-6986 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Mechanism of action:
  • Epigenetic
Targets:
  • Phosphatases

References: we are preparing a list of scientific research reports with V005-6986 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V005-6986?
Check Price and Availability of V005-6986, 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 V005-6986 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V005-6986
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V005-6986
  • 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 V005-6986 available by request