E560-0069 Screening compound: 2-fluoro-N-(2-{6-[(3-phenylpropyl)amino]-[1,2,4]triazolo[4,3-b]pyridazin-3-yl}ethyl)benzamide

E560-0069 Screening compound: 2-fluoro-N-(2-{6-[(3-phenylpropyl)amino]-[1,2,4]triazolo[4,3-b]pyridazin-3-yl}ethyl)benzamide
E560-0069 Screening compound: 2-fluoro-N-(2-{6-[(3-phenylpropyl)amino]-[1,2,4]triazolo[4,3-b]pyridazin-3-yl}ethyl)benzamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E560-0069
2-fluoro-N-(2-{6-[(3-phenylpropyl)amino]-[1,2,4]triazolo[4,3-b]pyridazin-3-yl}ethyl)benzamide

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

E560-0069

Molecular Formula

C23H23FN6O (C23 H23 FN6 O)

Compound Name

2-fluoro-N-(2-{6-[(3-phenylpropyl)amino]-[1,2,4]triazolo[4,3-b]pyridazin-3-yl}ethyl)benzamide

IUPAC name

2-fluoro-N-(2-{6-[(3-phenylpropyl)amino]-[124]triazolo[43-b]pyridazin-3-yl}ethyl)benzamide

SMILES

O=C(c(cccc1)c1F)NCCc1nnc(cc2)n1nc2NCCCc1ccccc1

InChI

InChI=1S/C23H23FN6O/c24-19-11-5-4-10-18(19)23(31)26-16-14-22-28-27-21-13-12-20(29-30(21)22)25-15-6-9-17-7-2-1-3-8-17/h1-5,7-8,10-13H,6,9,14-16H2,(H,25,29)(H,26,31)

InChI Key

DWJINNVGCSXSCV-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05961647

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

418.47

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

10.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.522

Distribution Coefficient, logD

3.522

Water Solubility, LogSw

-3.87

Polar Surface Area

68.543

Acid Dissociation Constant (pKa)

12.47

Base Dissociation Constant (pKb)

1.47

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

21.70

E560-0069 in Drug Discovery

Included in Screening Libraries

Protein Kinases Inhibitors Library (36801 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Nervous system
  • Hemic and lymphatic
  • Cardiovascular
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with E560-0069 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E560-0069?
Check Price and Availability of E560-0069, 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 E560-0069 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E560-0069
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E560-0069
  • 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 E560-0069 available by request