K072-0091 Screening compound: (E)-N-(4H-1,2,4-triazol-4-yl)-1-(2,3,4-trimethoxyphenyl)methanimine

K072-0091 Screening compound: (E)-N-(4H-1,2,4-triazol-4-yl)-1-(2,3,4-trimethoxyphenyl)methanimine
K072-0091 Screening compound: (E)-N-(4H-1,2,4-triazol-4-yl)-1-(2,3,4-trimethoxyphenyl)methanimine alternative view

Chemical Structure Depiction of ChemDiv screening compound K072-0091
(E)-N-(4H-1,2,4-triazol-4-yl)-1-(2,3,4-trimethoxyphenyl)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

K072-0091

Molecular Formula

C12H14N4O3 (C12 H14 N4 O3)

Compound Name

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

IUPAC name

(E)-N-(4H-124-triazol-4-yl)-1-(234-trimethoxyphenyl)methanimine

SMILES

COc1ccc(/C=N/n2cnnc2)c(OC)c1OC

InChI

InChI=1S/C12H14N4O3/c1-17-10-5-4-9(11(18-2)12(10)19-3)6-15-16-7-13-14-8-16/h4-8H,1-3H3

InChI Key

URGWXSWLZSSLHV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01248692

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

262.27

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

5.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

0.797

Distribution Coefficient, logD

0.791

Water Solubility, LogSw

-1.56

Polar Surface Area

57.271

Acid Dissociation Constant (pKa)

33.29

Base Dissociation Constant (pKb)

5.54

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

25.00

References: we are preparing a list of scientific research reports with K072-0091 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound K072-0091?
Check Price and Availability of K072-0091, 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 K072-0091 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for K072-0091
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for K072-0091
  • 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 K072-0091 available by request