E591-0928 Screening compound: 3-[6-(morpholin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-(3,4,5-trimethoxyphenyl)propanamide

E591-0928 Screening compound: 3-[6-(morpholin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-(3,4,5-trimethoxyphenyl)propanamide
E591-0928 Screening compound: 3-[6-(morpholin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-(3,4,5-trimethoxyphenyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound E591-0928
3-[6-(morpholin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-(3,4,5-trimethoxyphenyl)propanamide

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

E591-0928

Molecular Formula

C21H26N6O5 (C21 H26 N6 O5)

Compound Name

3-[6-(morpholin-4-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]-N-(3,4,5-trimethoxyphenyl)propanamide

IUPAC name

3-[6-(morpholin-4-yl)-[124]triazolo[43-b]pyridazin-3-yl]-N-(345-trimethoxyphenyl)propanamide

SMILES

COc1cc(NC(CCc2nnc(cc3)n2nc3N2CCOCC2)=O)cc(OC)c1OC

InChI

InChI=1S/C21H26N6O5/c1-29-15-12-14(13-16(30-2)21(15)31-3)22-20(28)7-6-18-24-23-17-4-5-19(25-27(17)18)26-8-10-32-11-9-26/h4-5,12-13H,6-11H2,1-3H3,(H,22,28)

InChI Key

AZDQXAMWRZLGIK-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD14901725

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

442.47

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

11

Partition Coefficient, logP

0.660

Distribution Coefficient, logD

0.660

Water Solubility, LogSw

-2.11

Polar Surface Area

90.325

Acid Dissociation Constant (pKa)

10.24

Base Dissociation Constant (pKb)

2.94

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

42.90

E591-0928 in Drug Discovery

Included in Screening Libraries

Antimitotic Tubulin Library (17355 compounds)

Dark Chemical Matter Library (18430 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer
  • Digestive system
  • Respiratory tract
  • Otorhinolaryngologic
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Structure:
  • Pool

References: we are preparing a list of scientific research reports with E591-0928 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound E591-0928?
Check Price and Availability of E591-0928, 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 E591-0928 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for E591-0928
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for E591-0928
  • 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 E591-0928 available by request