Bunazosin hydrochlorideProduct ingredient for Bunazosin
- Name
- Bunazosin hydrochloride
- Drug Entry
- Bunazosin
Bunazosin has been used in trials studying the treatment of High Blood Pressure.
- Accession Number
- DBSALT002161
- Structure
- Synonyms
- Bunazosin HCl / Bunazosin hydrochloride
- External IDs
- E-643 / E643
- UNII
- 18V54TZ7U6
- CAS Number
- 52712-76-2
- Weight
- Average: 409.92
Monoisotopic: 409.1880675 - Chemical Formula
- C19H28ClN5O3
- InChI Key
- NBGBEUITCPENLJ-UHFFFAOYSA-N
- InChI
- InChI=1S/C19H27N5O3.ClH/c1-4-6-17(25)23-7-5-8-24(10-9-23)19-21-14-12-16(27-3)15(26-2)11-13(14)18(20)22-19;/h11-12H,4-10H2,1-3H3,(H2,20,21,22);1H
- IUPAC Name
- 1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)-1,4-diazepan-1-yl]butan-1-one hydrochloride
- SMILES
- Cl.CCCC(=O)N1CCCN(CC1)C1=NC(N)=C2C=C(OC)C(OC)=CC2=N1
- External Links
- ChemSpider
- 103163
- ChEBI
- 31320
- ChEMBL
- CHEMBL3182014
- Predicted Properties
Property Value Source Water Solubility 0.584 mg/mL ALOGPS logP 2.66 ALOGPS logP 1.94 Chemaxon logS -2.8 ALOGPS pKa (Strongest Basic) 7.26 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 7 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 93.81 Å2 Chemaxon Rotatable Bond Count 5 Chemaxon Refractivity 105.53 m3·mol-1 Chemaxon Polarizability 40.08 Å3 Chemaxon Number of Rings 3 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon