3253-2092 Screening compound: (1E,2Z)-2-bromo-3-phenyl-N-(4H-1,2,4-triazol-4-yl)prop-2-en-1-imine

3253-2092 Screening compound: (1E,2Z)-2-bromo-3-phenyl-N-(4H-1,2,4-triazol-4-yl)prop-2-en-1-imine
3253-2092 Screening compound: (1E,2Z)-2-bromo-3-phenyl-N-(4H-1,2,4-triazol-4-yl)prop-2-en-1-imine alternative view

Chemical Structure Depiction of ChemDiv screening compound 3253-2092
(1E,2Z)-2-bromo-3-phenyl-N-(4H-1,2,4-triazol-4-yl)prop-2-en-1-imine

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

3253-2092

Molecular Formula

C11H9BrN4 (C11 H9 BrN4)

Compound Name

(1E,2Z)-2-bromo-3-phenyl-N-(4H-1,2,4-triazol-4-yl)prop-2-en-1-imine

IUPAC name

(1E2Z)-2-bromo-3-phenyl-N-(4H-124-triazol-4-yl)prop-2-en-1-imine

SMILES

Br/C(/C=N/n1cnnc1)=C\c1ccccc1

InChI

InChI=1S/C11H9BrN4/c12-11(6-10-4-2-1-3-5-10)7-15-16-8-13-14-9-16/h1-9H

InChI Key

ZXCWSHQQPVKZDQ-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01913295

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

277.12

Hydrogen Bond Acceptors Count

3.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

3.00

Number of Nitrogen and Oxygen Atoms

4

Partition Coefficient, logP

2.065

Distribution Coefficient, logD

2.064

Water Solubility, LogSw

-1.81

Polar Surface Area

34.206

Acid Dissociation Constant (pKa)

14.00

Base Dissociation Constant (pKb)

3.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

0.00

3253-2092 in Drug Discovery

Included in Screening Libraries

Antiviral Annotated Library (21441 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

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

Epitranscriptome Focused Small Molecule Library (20952 compounds)

New Agro Library (44492 compounds)

Included in 1.7M Stock Database

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

References: we are preparing a list of scientific research reports with 3253-2092 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3253-2092?
Check Price and Availability of 3253-2092, 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 3253-2092 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3253-2092
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3253-2092
  • 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 3253-2092 available by request