76099-35-9 Usage
Chemical structure
A complex organic compound with a heterocyclic structure containing an epoxide and a benzimidazole ring.
Potential applications
Pharmaceutical applications, particularly in the field of medicinal chemistry and drug discovery.
Biological activity
The presence of the epoxide group may make it a potential candidate for biological activity.
Structural features
Its structural features could make it suitable for further chemical modification and investigation.
Implications
Understanding its properties and potential uses could have implications for the development of new drugs and therapeutics.
Molecular weight
Approximately 270.30 g/mol (calculated from the molecular formula).
Functional groups
Epoxide, benzimidazole, and phenyl groups.
Solubility
The solubility of 1,4-(Epoxymethanol)-1H,3H-(1,4)oxazepino(4,3-a)benzimidazole, 4,5-dihy dro-1-phenyl- is not explicitly mentioned in the provided material, but it may be influenced by the presence of the epoxide and aromatic groups, which could affect its interactions with various solvents.
Stability
The stability of 1,4-(Epoxymethanol)-1H,3H-(1,4)oxazepino(4,3-a)benzimidazole, 4,5-dihy dro-1-phenyl- is not mentioned in the provided material, but the presence of the epoxide group may make it susceptible to nucleophilic attack and ring-opening reactions.
Reactivity
The compound may be reactive due to the presence of the epoxide group, which can undergo various reactions with nucleophiles, as well as the aromatic groups that can participate in electrophilic aromatic substitution reactions.
Synthesis
The synthesis of 1,4-(Epoxymethanol)-1H,3H-(1,4)oxazepino(4,3-a)benzimidazole, 4,5-dihy dro-1-phenyl- is not described in the provided material, but it likely involves the formation of the oxazepinobenzimidazole core followed by the introduction of the epoxide and phenyl groups.
Purification
The purification methods for 1,4-(Epoxymethanol)-1H,3H-(1,4)oxazepino(4,3-a)benzimidazole, 4,5-dihy dro-1-phenyl- are not mentioned in the provided material, but common techniques for similar complex organic compounds include column chromatography and crystallization.
Characterization
The characterization of 1,4-(Epoxymethanol)-1H,3H-(1,4)oxazepino(4,3-a)benzimidazole, 4,5-dihy dro-1-phenyl- would typically involve techniques such as nuclear magnetic resonance (NMR) spectroscopy, mass spectrometry (MS), and elemental analysis to confirm its structure and purity.
Check Digit Verification of cas no
The CAS Registry Mumber 76099-35-9 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 7,6,0,9 and 9 respectively; the second part has 2 digits, 3 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 76099-35:
(7*7)+(6*6)+(5*0)+(4*9)+(3*9)+(2*3)+(1*5)=159
159 % 10 = 9
So 76099-35-9 is a valid CAS Registry Number.
InChI:InChI=1/C18H16N2O2/c1-2-6-14(7-3-1)18-17-19-15-8-4-5-9-16(15)20(17)10-13(11-21-18)12-22-18/h1-9,13H,10-12H2
76099-35-9Relevant academic research and scientific papers
Synthesis and pharmacological properties of analogs of oxapadol, a new analgesic agent
Dostert,Langlois,Guerret,et al.
, p. 199 - 205 (2007/10/02)
A series of various heterocyclic compounds related to Oxapadol was prepared and evaluated for analgesic activity in mice. Some of them possessed significant analgesic effects; their structure activity relationships and chemistry are discussed. These compounds represent, in the authors' opinion, a unique series of analgesic agents.
