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88054-14-2,MFCD08685900
Catalog No.:AA00GULZ

88054-14-2 | 1H-Pyrazole,5-methyl-

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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00GULZ
Chemical Name:
1H-Pyrazole,5-methyl-
CAS Number:
88054-14-2
Molecular Formula:
C4H6N2
Molecular Weight:
82.1038
MDL Number:
MFCD08685900
SMILES:
Cc1ccn[nH]1
Properties
Computed Properties
 
Complexity:
44.8  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
XLogP3:
0.6  

Downstream Synthesis Route
36847-11-7    88054-14-2   
2,6-dibromo-4-(5-methyl-1H-pyrazol-3-ylamino)pyrimidine 

[1]CurrentPatentAssignee:ASTRAZENECAPLC-WO2005/40159,2005,A1Locationinpatent:Page/Pagecolumn210

[1]Patent:US6090803,2000,A

[2]Patent:EP1149096,2002,B1

[3]Patent:US6194407,2001,B1

[4]Patent:US6235900,2001,B1

[1]Attaryan;Baltayan;Sagatelyan;Takmazyan[RussianJournalofGeneralChemistry,2008,vol.78,#1,p.136-138]

[1]Badalyan;Akopyan;Attaryan;Asratyan[RussianJournalofGeneralChemistry,2014,vol.84,#4,p.793-795][Zh.Obshch.Khim.,2014,vol.84,#4,p.793-795,3]

578743-87-0    88054-14-2   
N,N′-bis(2,6-(di-isopropyl)phenyl)imidazol-2-ylidene(3-methyl-pyrazol-1-yl)copper(I) 

[1]ACSCatalysis,2017,vol.7,p.8176-8183

Literature

Title: Methyltrioxorhenium-catalyzed epoxidation of homoallylic alcohols with hydrogen peroxide.

Journal: The Journal of organic chemistry 20121102

Title: Evidence of the in vitro genotoxicity of methyl-pyrazole pesticides in human cells.

Journal: Mutation research 20121009

Title: Highly efficient redox isomerisation of allylic alcohols catalysed by pyrazole-based ruthenium(IV) complexes in water: mechanisms of bifunctional catalysis in water.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany) 20120618

Title: In vitro drug metabolism by C-terminally truncated human flavin-containing monooxygenase 3.

Journal: Biochemical pharmacology 20120215

Title: A retrospective analysis of glycol and toxic alcohol ingestion: utility of anion and osmolal gaps.

Journal: BMC clinical pathology 20120101

Title: Application of 2-trichloromethylbenzimidazole in analytical chemistry: a highly selective chromogenic reagent for thin-layer chromatography and some other analytical uses.

Journal: Journal of analytical methods in chemistry 20120101

Title: Structure and electronic properties of Alq3 derivatives with electron acceptor/donor groups at the C4 positions of the quinolate ligands: a theoretical study.

Journal: Journal of molecular modeling 20111201

Title: Combination of two pharmacophoric systems: synthesis and pharmacological evaluation of spirocyclic pyranopyrazoles with high σ₁ receptor affinity.

Journal: Journal of medicinal chemistry 20111013

Title: An integrated chemical biology approach identifies specific vulnerability of Ewing's sarcoma to combined inhibition of Aurora kinases A and B.

Journal: Molecular cancer therapeutics 20111001

Title: Synthesis and structure of ruthenium(IV) complexes featuring N-heterocyclic ligands with an N-H group as the hydrogen-bond donor: hydrogen interactions in solution and in the solid state.

Journal: Inorganic chemistry 20110606

Title: Influence of N-donor bases and the solvent in oxodiperoxomolybdenum catalysed olefin epoxidation with hydrogen peroxide in ionic liquids.

Journal: Dalton transactions (Cambridge, England : 2003) 20110521

Title: Crystal structures of ABL-related gene (ABL2) in complex with imatinib, tozasertib (VX-680), and a type I inhibitor of the triazole carbothioamide class.

Journal: Journal of medicinal chemistry 20110414

Title: Management of toxic ingestions with the use of renal replacement therapy.

Journal: Pediatric nephrology (Berlin, Germany) 20110401

Title: The lack of target specificity of small molecule anticancer kinase inhibitors is correlated with their ability to damage myocytes in vitro.

Journal: Toxicology and applied pharmacology 20101201

Title: An effective procedure for the synthesis of acid-sensitive epoxides: use of 1-methylimidazole as the additive on methyltrioxorhenium-catalyzed epoxidation of alkenes with hydrogen peroxide.

Journal: Organic & biomolecular chemistry 20100521

Title: Gateways to clinical trials.

Journal: Methods and findings in experimental and clinical pharmacology 20100501

Title: NMR and theoretical study on interactions between diperoxovanadate complex and pyrazole-like ligands.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20100301

Title: A novel tripodal ligand containing three different N-heterocyclic donor functions and its application in catechol dioxygenase mimicking.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany) 20090101

Title: Biotransformation and pharmacokinetics of the novel anticancer drug, SYUIQ-5, in the rat.

Journal: Investigational new drugs 20080401

Title: An improved methyltrioxorhenium-catalyzed epoxidation of alkenes with hydrogen peroxide.

Journal: Organic & biomolecular chemistry 20070707

Title: Scaffold hopping, synthesis and structure-activity relationships of 5,6-diaryl-pyrazine-2-amide derivatives: a novel series of CB1 receptor antagonists.

Journal: Bioorganic & medicinal chemistry 20070615

Title: Characterization of peptide-pyrazole interactions in solution by low-temperature NMR studies.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany) 20070101

Title: Pyrazole and methylpyrazole for the treatment of 2-butoxyethanol poisoning.

Journal: Acta poloniae pharmaceutica 20070101

Title: Methylpyrazole-capped two-dimensional supramolecular M(II) (M = Mn, Ni, Co) assemblies constructed by covalent and noncovalent interactions: uncommon coordination modes of methylpyrazoles and magnetic properties.

Journal: Inorganic chemistry 20060724

Title: Formation of 4'-carboxyl acid metabolite of imrecoxib by rat liver microsomes.

Journal: Acta pharmacologica Sinica 20060401

Title: Role of rat liver cytochrome P450 3A and 2D in metabolism of imrecoxib.

Journal: Acta pharmacologica Sinica 20060301

Title: From model compounds to protein binding: syntheses, characterizations and fluorescence studies of [RuII(bipy)(terpy)L]2+ complexes (bipy = 2,2'-bipyridine; terpy = 2,2':6',2''-terpyridine; L = imidazole, pyrazole and derivatives, cytochrome c).

Journal: Dalton transactions (Cambridge, England : 2003) 20050121

Title: Characterization of enzymes responsible for biotransformation of the new antileukotrienic drug quinlukast in rat liver microsomes and in primary cultures of rat hepatocytes.

Journal: The Journal of pharmacy and pharmacology 20040201

Title: Towards evidence based emergency medicine: best BETs from the Manchester Royal Infirmary. Management of acute ethylene glycol poisoning.

Journal: Emergency medicine journal : EMJ 20020901

Title: Spectroscopic study on charge transfer molecular complexes of pyrazole derivatives with some pi-electron acceptors.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20020701

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Tags:88054-14-2 Molecular Formula|88054-14-2 MDL|88054-14-2 SMILES|88054-14-2 1H-Pyrazole,5-methyl-