2708-0012 Screening compound: methyl 3-(2-methylphenyl)-1,2-oxazole-5-carboxylate

2708-0012 Screening compound: methyl 3-(2-methylphenyl)-1,2-oxazole-5-carboxylate
2708-0012 Screening compound: methyl 3-(2-methylphenyl)-1,2-oxazole-5-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound 2708-0012
methyl 3-(2-methylphenyl)-1,2-oxazole-5-carboxylate

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

2708-0012

Molecular Formula

C12H11NO3 (C12 H11 NO3)

Compound Name

methyl 3-(2-methylphenyl)-1,2-oxazole-5-carboxylate

IUPAC name

methyl 3-(2-methylphenyl)-12-oxazole-5-carboxylate

SMILES

Cc(cccc1)c1-c1noc(C(OC)=O)c1

InChI

InChI=1S/C12H11NO3/c1-8-5-3-4-6-9(8)10-7-11(16-13-10)12(14)15-2/h3-7H,1-2H3

InChI Key

WQHONNZEEONLAX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02737756

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

217.22

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.830

Distribution Coefficient, logD

2.830

Water Solubility, LogSw

-3.29

Polar Surface Area

42.948

Acid Dissociation Constant (pKa)

27.78

Base Dissociation Constant (pKb)

-6.96

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

2708-0012 in Drug Discovery

Included in Screening Libraries

Anti-Aging Library (44940 compounds)

Antiparasite Library (23996 compounds)

Cardiovascular Library (22201 compounds)

Fragments Library (11262 compounds)

GABA Library (7115 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Metabolic
  • Immune system
  • Infections
  • Immune system
  • animal
  • Cardiovascular
  • Eye
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic
  • Receptor's ligands
  • Epigenetic
Agro:
  • Agro
Structure:
  • Fragments
Targets:
  • GPCR
  • Ion Channels

References: we are preparing a list of scientific research reports with 2708-0012 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2708-0012?
Check Price and Availability of 2708-0012, 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 2708-0012 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2708-0012
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2708-0012
  • 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 2708-0012 available by request