2216-0020 Screening compound: (E)-1-(2,3-dichlorophenyl)-N-(4H-1,2,4-triazol-4-yl)methanimine

2216-0020 Screening compound: (E)-1-(2,3-dichlorophenyl)-N-(4H-1,2,4-triazol-4-yl)methanimine
2216-0020 Screening compound: (E)-1-(2,3-dichlorophenyl)-N-(4H-1,2,4-triazol-4-yl)methanimine alternative view

Chemical Structure Depiction of ChemDiv screening compound 2216-0020
(E)-1-(2,3-dichlorophenyl)-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

2216-0020

Molecular Formula

C9H6Cl2N4 (C9 H6 Cl2 N4)

Compound Name

(E)-1-(2,3-dichlorophenyl)-N-(4H-1,2,4-triazol-4-yl)methanimine

IUPAC name

(E)-1-(23-dichlorophenyl)-N-(4H-124-triazol-4-yl)methanimine

SMILES

Clc(cccc1/C=N/n2cnnc2)c1Cl

InChI

InChI=1S/C9H6Cl2N4/c10-8-3-1-2-7(9(8)11)4-14-15-5-12-13-6-15/h1-6H

InChI Key

SMJZMXGQDPFVFV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD00980097

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

241.08

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.132

Distribution Coefficient, logD

2.132

Water Solubility, LogSw

-3.10

Polar Surface Area

34.206

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

4.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

2216-0020 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

Epitranscriptome Focused Small Molecule Library (20952 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 2216-0020 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2216-0020?
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What is the minimum amount of 2216-0020 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2216-0020
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2216-0020
  • 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 2216-0020 available by request