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14389-12-9

14389-12-9 | 5-(4-PYRIDYL)-1H-TETRAZOLE

CAS No: 14389-12-9 Catalog No: AG001IL9 MDL No:MFCD00068115

Product Description

Catalog Number:
AG001IL9
Chemical Name:
5-(4-PYRIDYL)-1H-TETRAZOLE
CAS Number:
14389-12-9
Molecular Formula:
C6H5N5
Molecular Weight:
147.1374
MDL Number:
MFCD00068115
IUPAC Name:
4-(2H-tetrazol-5-yl)pyridine
InChI:
InChI=1S/C6H5N5/c1-3-7-4-2-5(1)6-8-10-11-9-6/h1-4H,(H,8,9,10,11)
InChI Key:
JMILUUVWLRKJFB-UHFFFAOYSA-N
SMILES:
n1ccc(cc1)c1n[nH]nn1

Properties

Complexity:
122  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
147.054g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
147.141g/mol
Monoisotopic Mass:
147.054g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  

Literature

Title Journal
Two metal-organic frameworks constructed from one-dimensional cobalt(II) ferrimagnetic chains with alternating antiferromagnetic/ferromagnetic and AF/AF/FM interaction: synthesis, structures, and magnetic properties. Inorganic chemistry 20120618
Discovery of (pyridin-4-yl)-2H-tetrazole as a novel scaffold to identify highly selective matrix metalloproteinase-13 inhibitors for the treatment of osteoarthritis. Bioorganic & medicinal chemistry letters 20100115
Cheminformatics-based drug design approach for identification of inhibitors targeting the characteristic residues of MMP-13 hemopexin domain. PloS one 20100101
Solid-state coordination chemistry of copper(II) tetrazolates: anion control of frameworks constructed from trinuclear copper(II) building blocks. Inorganic chemistry 20090601
A new cobalt(II) complex with 5-(4-pyrid-yl)tetra-zole ligands. Acta crystallographica. Section E, Structure reports online 20081101
Synthesis and structures of 5-(pyridyl)tetrazole complexes of Mn(II). Dalton transactions (Cambridge, England : 2003) 20050721
Antimycobacterial activity of substituted isosteres of pyridine- and pyrazinecarboxylic acids. Journal of medicinal chemistry 19980618

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