8008-6635 Screening compound: (E)-1-[5-(3-chlorophenyl)furan-2-yl]-N-(4H-1,2,4-triazol-4-yl)methanimine

8008-6635 Screening compound: (E)-1-[5-(3-chlorophenyl)furan-2-yl]-N-(4H-1,2,4-triazol-4-yl)methanimine
8008-6635 Screening compound: (E)-1-[5-(3-chlorophenyl)furan-2-yl]-N-(4H-1,2,4-triazol-4-yl)methanimine alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-6635
(E)-1-[5-(3-chlorophenyl)furan-2-yl]-N-(4H-1,2,4-triazol-4-yl)methanimine

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

8008-6635

Molecular Formula

C13H9ClN4O (C13 H9 ClN4 O)

Compound Name

(E)-1-[5-(3-chlorophenyl)furan-2-yl]-N-(4H-1,2,4-triazol-4-yl)methanimine

IUPAC name

(E)-1-[5-(3-chlorophenyl)furan-2-yl]-N-(4H-124-triazol-4-yl)methanimine

SMILES

Clc1cc(-c2ccc(/C=N/n3cnnc3)o2)ccc1

InChI

InChI=1S/C13H9ClN4O/c14-11-3-1-2-10(6-11)13-5-4-12(19-13)7-17-18-8-15-16-9-18/h1-9H

InChI Key

HHOKVDMSSMHCEJ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00606503

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

272.69

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

2.597

Distribution Coefficient, logD

2.596

Water Solubility, LogSw

-3.24

Polar Surface Area

41.776

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

4.69

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

8008-6635 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Antiviral Annotated Library (21441 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8008-6635 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-6635?
Check Price and Availability of 8008-6635, 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 8008-6635 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-6635
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-6635
  • 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 8008-6635 available by request