8019-8542 Screening compound: [5-(2-chlorophenyl)-1,2,4-oxadiazol-3-yl]methanamine

8019-8542 Screening compound: [5-(2-chlorophenyl)-1,2,4-oxadiazol-3-yl]methanamine
8019-8542 Screening compound: [5-(2-chlorophenyl)-1,2,4-oxadiazol-3-yl]methanamine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-8542
[5-(2-chlorophenyl)-1,2,4-oxadiazol-3-yl]methanamine

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

8019-8542

Molecular Formula

C9H8ClN3O (C9 H8 ClN3 O)

Compound Name

[5-(2-chlorophenyl)-1,2,4-oxadiazol-3-yl]methanamine

IUPAC name

1-[5-(2-chlorophenyl)-124-oxadiazol-3-yl]methanamine

SMILES

NCc1noc(-c(cccc2)c2Cl)n1

InChI

InChI=1S/C9H8ClN3O/c10-7-4-2-1-3-6(7)9-12-8(5-11)13-14-9/h1-4H,5,11H2

InChI Key

OWKCXCJLPXVBPE-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD07364473

Chemical and Physical Properties

Saltdata

HCl

Molecular Weight

209.63

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

1.066

Distribution Coefficient, logD

1.061

Water Solubility, LogSw

-2.82

Polar Surface Area

54.567

Acid Dissociation Constant (pKa)

24.12

Base Dissociation Constant (pKb)

5.43

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.11

8019-8542 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Fragments Library (11262 compounds)

GABA Library (7115 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Ion Channels Focused Library (26372 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 8019-8542 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-8542?
Check Price and Availability of 8019-8542, 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 8019-8542 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-8542
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-8542
  • 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 8019-8542 available by request