J075-0481 Screening compound: 3,3,3-trifluoro-N-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]propanamide

J075-0481 Screening compound: 3,3,3-trifluoro-N-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]propanamide
J075-0481 Screening compound: 3,3,3-trifluoro-N-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound J075-0481
3,3,3-trifluoro-N-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]propanamide

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

J075-0481

Molecular Formula

C12H10F3N3O2 (C12 H10 F3 N3 O2)

Compound Name

3,3,3-trifluoro-N-[(5-phenyl-1,2,4-oxadiazol-3-yl)methyl]propanamide

IUPAC name

333-trifluoro-N-[(5-phenyl-124-oxadiazol-3-yl)methyl]propanamide

SMILES

O=C(CC(F)(F)F)NCc1noc(-c2ccccc2)n1

InChI

InChI=1S/C12H10F3N3O2/c13-12(14,15)6-10(19)16-7-9-17-11(20-18-9)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,16,19)

InChI Key

UFKGDAMEXXYOJO-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27223355

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

285.23

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.109

Distribution Coefficient, logD

2.109

Water Solubility, LogSw

-2.51

Polar Surface Area

57.378

Acid Dissociation Constant (pKa)

14.08

Base Dissociation Constant (pKb)

-5.05

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

J075-0481 in Drug Discovery

Included in Screening Libraries

Anti-Inflammatory Library (24602 compounds)

Soluble Diversity Library (15920 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Immune system
  • Nervous system
  • Hemic and lymphatic
  • Congenital
  • Metabolic
Mechanism of action:
  • Epigenetic

References: we are preparing a list of scientific research reports with J075-0481 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound J075-0481?
Check Price and Availability of J075-0481, 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 J075-0481 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for J075-0481
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for J075-0481
  • 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 J075-0481 available by request