D718-1671 Screening compound: ethyl 4-(2-{5-oxo-2-phenyl-4H,5H,6H-imidazo[1,2-b][1,2,4]triazol-6-yl}acetamido)benzoate

D718-1671 Screening compound: ethyl 4-(2-{5-oxo-2-phenyl-4H,5H,6H-imidazo[1,2-b][1,2,4]triazol-6-yl}acetamido)benzoate
D718-1671 Screening compound: ethyl 4-(2-{5-oxo-2-phenyl-4H,5H,6H-imidazo[1,2-b][1,2,4]triazol-6-yl}acetamido)benzoate alternative view

Chemical Structure Depiction of ChemDiv screening compound D718-1671
ethyl 4-(2-{5-oxo-2-phenyl-4H,5H,6H-imidazo[1,2-b][1,2,4]triazol-6-yl}acetamido)benzoate

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

D718-1671

Molecular Formula

C21H19N5O4 (C21 H19 N5 O4)

Compound Name

ethyl 4-(2-{5-oxo-2-phenyl-4H,5H,6H-imidazo[1,2-b][1,2,4]triazol-6-yl}acetamido)benzoate

IUPAC name

ethyl 4-(2-{5-oxo-2-phenyl-4H5H6H-imidazo[12-b][124]triazol-6-yl}acetamido)benzoate

SMILES

CCOC(c(cc1)ccc1NC(CC1n2nc(-c3ccccc3)nc2NC1=O)=O)=O

InChI

InChI=1S/C21H19N5O4/c1-2-30-20(29)14-8-10-15(11-9-14)22-17(27)12-16-19(28)24-21-23-18(25-26(16)21)13-6-4-3-5-7-13/h3-11,16H,2,12H2,1H3,(H,22,27)(H,23,24,25,28)/t16-/m0/s1

InChI Key

LZNHQAFHTXXKBE-INIZCTEOSA-N

MDL Number (MFCD)

MFCD12209985

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

405.41

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

9

Partition Coefficient, logP

3.023

Distribution Coefficient, logD

3.023

Water Solubility, LogSw

-3.32

Polar Surface Area

95.141

Acid Dissociation Constant (pKa)

10.49

Base Dissociation Constant (pKb)

0.33

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

19.00

D718-1671 in Drug Discovery

Included in Screening Libraries

Integrin Receptors Targeted library (1715 compounds)

Protein Kinases Inhibitors Library (36801 compounds)

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

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Musculoskeletal
  • Digestive system
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Immune system
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
  • Cancer
  • Nervous system
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
  • Endocrine
Targets:
  • Others
  • Kinases
  • Phosphatases

References: we are preparing a list of scientific research reports with D718-1671 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound D718-1671?
Check Price and Availability of D718-1671, 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 D718-1671 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for D718-1671
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for D718-1671
  • 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 D718-1671 available by request