54945-23-2

Basic information

• Product Name: 1,5,13,17,22-Pentaazatricyclo[15.2.2.17,11]docosa-7,9,11(22)-triene-6,12-dione
• Synonyms: 5,9-diaza-1-(1,4)piperidina-7-(2,6)pyridina-dodecaphane-6,8-dione
• CAS NO: 54945-23-2
• Molecular Formula: C17H25N5O2
• Molecular Weight: 331.418
• Mol File: 54945-23-2.mol
• Article Data: 1

Chemical Properties

• Appearance: /
• CAS DataBase Reference: 1,5,13,17,22-Pentaazatricyclo[15.2.2.17,11]docosa-7,9,11(22)-triene-6,12-dione(CAS DataBase Reference)
• NIST Chemistry Reference: 1,5,13,17,22-Pentaazatricyclo[15.2.2.17,11]docosa-7,9,11(22)-triene-6,12-dione(54945-23-2)
• EPA Substance Registry System: 1,5,13,17,22-Pentaazatricyclo[15.2.2.17,11]docosa-7,9,11(22)-triene-6,12-dione(54945-23-2)

Safety Data

• Hazardous Substances Data: 54945-23-2(Hazardous Substances Data)

Usage

Molecular structure

1,5,13,17,22-Pentaazatricyclo[15.2.2.17,11]docosa-7,9,11(22)-triene-6,12-dione has a complex molecular structure with a tricyclic ring system and five nitrogen atoms.

Nitrogen atoms

The compound contains five nitrogen atoms, which may contribute to its potential applications in various chemical fields.

Tricyclic ring system

The compound features a tricyclic ring system, which is a key aspect of its unique structure.

Dione functional group

The compound has a dione functional group, which consists of two carbonyl groups (C=O) attached to the same carbon atom.

Potential applications

Due to its intricate structure and the presence of nitrogen atoms, the compound may have potential applications in pharmaceuticals, materials science, or other specialized chemical fields.

Reactions and behaviors

The complex molecular structure of the compound suggests that it may have interesting and unique reactions and behaviors when interacting with other chemicals.

Availability of information

The exact properties and uses of this compound are not readily available, indicating that it may be a relatively new or less-studied compound.

Upstream product

• 7209-38-3 1,4-bis(3-aminopropyl)piperazine 
• 3739-94-4 2,6-Pyridinedicarbonyl dichloride 

Relevant articles and documents

Synthesis and Co-ordination Chemistry of Two Penta-azamacrocycles containing a 1,4-Piperazine Backbone. Crystal Structure Determinations of 6,12-Dioxo-1,5,13,17,22-penta-azatricyclo7,11>docosa-7(22),8,10-triene and 1,5,13,17,22-Penta-azatricyclo7,11>docosa-...

Two closely related pyridine-containing penta-azamacrocycles with a 1,4-piperazine backbone have been prepared, and the co-ordination chemistry of one of them 7,11>docosa-7(22),8,10-triene, L2> with nickel(II), copper(II), and zinc(II) investigated.L2 was obtained in low yield from the related diamide macrocycle 6,12-dioxo-1,5,13,17,22-penta-azatricyclo7,11>docosa-7(22),8,10-triene, L1, by reduction with BH3.thf (thf = tetrahydrofuran).The crystal structure of L1 shows that the 1,4-piperazine backbone adopts a chair conformation, with the lone pairs of the two 1,4-piperazine N atoms pointing in opposite directions, unfavorable for chelation.Complexes of L1 could not be isolated.Complexes of L2 with Ni(2+), Cu(2+), and Zn(2+) were readily obtained, and the crystal structure of 2)>2 shows the 1,4-piperazine is in the boat conformation required for chelation.The Ni(2+) is co-ordinated to all five N atoms of the macrocycle in a symmetric, but distorted, trigonal-bipyramidal geometry, with the pyridine ring at right angles to the plane of the carbon framework of the 1,4-piperazine backbone.The pyridine and two 1,4-piperazine N atoms are equatorial, and the other two N atoms axial; the Ni-N bond lengths are in the ranges 2.16 - 2.18 Angstroem (axial) and 2.02 - 2.08 Angstroem (equatorial), with the Ni-pyridine-N bond length being the shortest.The 13C n.m.r. spectrum of the Zn(2+) complex is consistent with the same symmetric structure as the Ni(2+) complex.