8019-6485 Screening compound: 5-(2-bromophenyl)-1,3,4-oxadiazol-2-amine

8019-6485 Screening compound: 5-(2-bromophenyl)-1,3,4-oxadiazol-2-amine
8019-6485 Screening compound: 5-(2-bromophenyl)-1,3,4-oxadiazol-2-amine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8019-6485
5-(2-bromophenyl)-1,3,4-oxadiazol-2-amine

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

8019-6485

Molecular Formula

C8H6BrN3O (C8 H6 BrN3 O)

Compound Name

5-(2-bromophenyl)-1,3,4-oxadiazol-2-amine

IUPAC name

5-(2-bromophenyl)-134-oxadiazol-2-amine

SMILES

Nc1nnc(-c(cccc2)c2Br)o1

InChI

InChI=1S/C8H6BrN3O/c9-6-4-2-1-3-5(6)7-11-12-8(10)13-7/h1-4H,(H2,10,12)

InChI Key

LNDBYEJRHXWCOG-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD09028330

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

240.06

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

1.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

0.967

Distribution Coefficient, logD

0.967

Water Solubility, LogSw

-2.06

Polar Surface Area

52.090

Acid Dissociation Constant (pKa)

18.82

Base Dissociation Constant (pKb)

1.56

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8019-6485 in Drug Discovery

Included in Screening Libraries

Fragments Library (11262 compounds)

GABA Library (7115 compounds)

Crystallographic and 19F NMR fragment-libraries (624 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

Structure:
  • Fragments
Therapeutical areas:
  • Eye
Targets:
  • GPCR
  • Ion Channels
Mechanism of action:
  • Receptor's ligands
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8019-6485 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8019-6485?
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What is the minimum amount of 8019-6485 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8019-6485
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8019-6485
  • 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 8019-6485 available by request