Bunazosin

Base Information

• Chemical Name: Bunazosin
• CAS No.: 80755-51-7
• Molecular Formula: C19H27N5O3
• Molecular Weight: 373.455
• UNII: 9UUW4V7G2H
• DSSTox Substance ID: DTXSID7022700
• Nikkaji Number: J32.851K
• Wikipedia: Bunazosin
• Wikidata: Q4997419
• NCI Thesaurus Code: C72922
• Pharos Ligand ID: J3L5PL6W15BA
• Metabolomics Workbench ID: 144284
• ChEMBL ID: CHEMBL188185
• Mol file: 80755-51-7.mol

Synonyms:4-amino-2-(4-butanoylhexahydro-1H-1,4-diazepin-1-yl)-6,7-dimethoxyquinazoline HCl;Andante;bunazocine;bunazosin;bunazosin hydrochloride;E 643;E-643;E643

Chemical Property of Bunazosin

Chemical Property:

• Boiling Point: 620.6 °C at 760 mmHg
• PKA: 10.37±0.70(Predicted)
• Flash Point: 329.1 °C
• PSA: 93.81000
• Density: 1.221 g/cm³
• LogP: 2.65210
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 5
• Exact Mass: 373.21138974
• Heavy Atom Count: 27
• Complexity: 494

Purity/Quality:

98%Min ^*data from raw suppliers

Bunazosin ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(=O)N1CCCN(CC1)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC
• Recent ClinicalTrials: Effects of Combination Therapy With Alpha-1 Blocker (Bunazosin or Doxazosin) in the Treatment of Patients With Mild to Moderate Essential Hypertension
• Uses: Bunazosin is an α-1 adrenergic receptor antagonist that acts as an anti-cancer and anti-glaucoma drug.

Technology Process of Bunazosin

There total 2 articles about Bunazosin which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 71.0%

→ 6-hydroxy-7-methoxy-1-tetralone (15288-02-5) + bunazosin (80755-51-7)

Guidance literature:

Reference yield:

→ 2-chloropyrimidine (1722-12-9,1195939-87-7) + bunazosin (80755-51-7)

Guidance literature:

With n-butyllithium; In hexane;

Refernces

• 1、 -. "Formation and composition of new optically active compounds". . . Retrieved 2008/06/13.