C201-2046 Screening compound: 3-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid

C201-2046 Screening compound: 3-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid
C201-2046 Screening compound: 3-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid alternative view

Chemical Structure Depiction of ChemDiv screening compound C201-2046
3-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid

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

C201-2046

Molecular Formula

C12H12N2O4 (C12 H12 N2 O4)

Compound Name

3-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid

IUPAC name

3-[3-(2-methoxyphenyl)-124-oxadiazol-5-yl]propanoic acid

SMILES

COc(cccc1)c1-c1noc(CCC(O)=O)n1

InChI

InChI=1S/C12H12N2O4/c1-17-9-5-3-2-4-8(9)12-13-10(18-14-12)6-7-11(15)16/h2-5H,6-7H2,1H3,(H,15,16)

InChI Key

IQXXNMCDSHIYDO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07392301

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

248.24

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.708

Distribution Coefficient, logD

-1.131

Water Solubility, LogSw

-2.28

Polar Surface Area

67.596

Acid Dissociation Constant (pKa)

4.56

Base Dissociation Constant (pKb)

-3.46

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

C201-2046 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

STING Agonist Library (5895 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
  • Cancer
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Agro:
  • Agro
Targets:
  • Others
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with C201-2046 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C201-2046?
Check Price and Availability of C201-2046, 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 C201-2046 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C201-2046
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C201-2046
  • 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 C201-2046 available by request