2083-0519 Screening compound: (Z)-1-[4-(benzyloxy)-3-methoxyphenyl]-N-(4H-1,2,4-triazol-4-yl)methanimine

2083-0519 Screening compound: (Z)-1-[4-(benzyloxy)-3-methoxyphenyl]-N-(4H-1,2,4-triazol-4-yl)methanimine
2083-0519 Screening compound: (Z)-1-[4-(benzyloxy)-3-methoxyphenyl]-N-(4H-1,2,4-triazol-4-yl)methanimine alternative view

Chemical Structure Depiction of ChemDiv screening compound 2083-0519
(Z)-1-[4-(benzyloxy)-3-methoxyphenyl]-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

2083-0519

Molecular Formula

C17H16N4O2 (C17 H16 N4 O2)

Compound Name

(Z)-1-[4-(benzyloxy)-3-methoxyphenyl]-N-(4H-1,2,4-triazol-4-yl)methanimine

IUPAC name

(Z)-1-[4-(benzyloxy)-3-methoxyphenyl]-N-(4H-124-triazol-4-yl)methanimine

SMILES

COc(cc(/C=N\n1cnnc1)cc1)c1OCc1ccccc1

InChI

InChI=1S/C17H16N4O2/c1-22-17-9-15(10-20-21-12-18-19-13-21)7-8-16(17)23-11-14-5-3-2-4-6-14/h2-10,12-13H,11H2,1H3

InChI Key

WLISNYPSQRCRJY-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01347146

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

308.34

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

1.927

Distribution Coefficient, logD

1.921

Water Solubility, LogSw

-2.24

Polar Surface Area

49.151

Acid Dissociation Constant (pKa)

29.40

Base Dissociation Constant (pKb)

5.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

11.80

2083-0519 in Drug Discovery

Included in Screening Libraries

Lipid Metabolism Library (9174 compounds)

Selective Target Activity Profiling Library (14702 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with 2083-0519 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2083-0519?
Check Price and Availability of 2083-0519, 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 2083-0519 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2083-0519
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2083-0519
  • 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 2083-0519 available by request