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37115-43-8,MFCD00171226
Catalog No.:AA01CBGL

37115-43-8 | 4H-[1,2,4]Triazolo[4,3-a][1,4]benzodiazepine-1-methanol,8-chloro-6-phenyl-

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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA01CBGL
Chemical Name:
4H-[1,2,4]Triazolo[4,3-a][1,4]benzodiazepine-1-methanol,8-chloro-6-phenyl-
CAS Number:
37115-43-8
Molecular Formula:
C17H13ClN4O
Molecular Weight:
324.7643
MDL Number:
MFCD00171226
SMILES:
OCc1nnc2n1c1ccc(cc1C(=NC2)c1ccccc1)Cl
Properties
Properties
 
MP:
165 - 170°C  
Storage:
-20 ℃;  

Computed Properties
 
Complexity:
454  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
0.9  

Literature

Title: Metabolism of alprazolam (a marker of CYP3A4) in hemodialysis patients with persistent inflammation.

Journal: European journal of clinical pharmacology 20120501

Title: Use of conventional bioanalytical devices to automate DBS extractions in liquid-handling dispensing tips.

Journal: Bioanalysis 20111001

Title: Quantitation of benzodiazepines in blood and urine using gas chromatography-mass spectrometry (GC-MS).

Journal: Methods in molecular biology (Clifton, N.J.) 20100101

Title: LC-MS/MS analysis of 13 benzodiazepines and metabolites in urine, serum, plasma, and meconium.

Journal: Methods in molecular biology (Clifton, N.J.) 20100101

Title: Metabolic interaction between ethanol, high-dose alprazolam and its two main metabolites using human liver microsomes in vitro.

Journal: Journal of forensic and legal medicine 20070801

Title: Inhibition of CYP3A4 and CYP3A5 catalyzed metabolism of alprazolam and quinine by ketoconazole as racemate and four different enantiomers.

Journal: European journal of clinical pharmacology 20070201

Title: Alprazolam as a probe for CYP3A using a single blood sample: pharmacokinetics of parent drug, and of alpha- and 4-hydroxy metabolites in healthy subjects.

Journal: European journal of clinical pharmacology 20050401

Title: Simultaneous quantification of alprazolam, 4- and alpha-hydroxyalprazolam in plasma samples using liquid chromatography mass spectrometry.

Journal: Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20050105

Title: [Determination of alpha-hydroxytrizolam and alpha hydroxyaplrazolam from urine by acetylation derivatization using gas chromatography electron capture detection].

Journal: Se pu = Chinese journal of chromatography 20041101

Title: Differential metabolism of alprazolam by liver and brain cytochrome (P4503A) to pharmacologically active metabolite.

Journal: The pharmacogenomics journal 20020101

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SDS
Tags:37115-43-8 Molecular Formula|37115-43-8 MDL|37115-43-8 SMILES|37115-43-8 4H-[1,2,4]Triazolo[4,3-a][1,4]benzodiazepine-1-methanol,8-chloro-6-phenyl-