E143-0047 Screening compound: 4-{4-benzyl-5-oxo-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-1-yl}benzonitrile

E143-0047 Screening compound: 4-{4-benzyl-5-oxo-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-1-yl}benzonitrile
E143-0047 Screening compound: 4-{4-benzyl-5-oxo-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-1-yl}benzonitrile alternative view

Chemical Structure Depiction of ChemDiv screening compound E143-0047
4-{4-benzyl-5-oxo-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-1-yl}benzonitrile

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

E143-0047

Molecular Formula

C23H15N5O (C23 H15 N5 O)

Compound Name

4-{4-benzyl-5-oxo-4H,5H-[1,2,4]triazolo[4,3-a]quinazolin-1-yl}benzonitrile

IUPAC name

4-{4-benzyl-5-oxo-4H5H-[124]triazolo[43-a]quinazolin-1-yl}benzonitrile

SMILES

N#Cc(cc1)ccc1-c(n1-c2c3cccc2)nnc1N(Cc1ccccc1)C3=O

InChI

InChI=1S/C23H15N5O/c24-14-16-10-12-18(13-11-16)21-25-26-23-27(15-17-6-2-1-3-7-17)22(29)19-8-4-5-9-20(19)28(21)23/h1-13H,15H2

InChI Key

QPEALVTYTLMHHM-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD06404565

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

377.41

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

3.785

Distribution Coefficient, logD

3.785

Water Solubility, LogSw

-4.26

Polar Surface Area

55.786

Acid Dissociation Constant (pKa)

21.41

Base Dissociation Constant (pKb)

-2.97

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

4.30

E143-0047 in Drug Discovery

Included in Screening Libraries

Allosteric Kinases Inhibitors Library (23117 compounds)

Antiviral Library (67538 compounds)

Protein Tyrosine Phosphatase Non-receptor Type (PTPN) Targeted Library (32556 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Female
  • Congenital
  • Skin
  • Antiviral
  • Infections
  • Immune system
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Kinases
  • Phosphatases

References: we are preparing a list of scientific research reports with E143-0047 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E143-0047?
Check Price and Availability of E143-0047, 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 E143-0047 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E143-0047
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E143-0047
  • 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 E143-0047 available by request