Bunazosin Hydrochloride
TL;DR: Bunazosin Hydrochloride (CAS 52712-76-2) is a chemical compound with molecular formula C19H28ClN5O3 and molecular weight 409.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)-1,4-diazepan-1-yl]butan-1-one;hydrochloride
Also Known As: bunazosin hydrochloride, Detantol, Bunazosin HCl, Andante, DDQ (pharmaceutical)
| Molecular Formula | C19H28ClN5O3 |
|---|---|
| Molecular Weight | 409.19 g/mol |
| LogP | 2.49 |
| Topological Polar Surface Area | 93.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 409.18808 |
| Heavy Atoms | 28 |
| Complexity | 494.0 |
Chemical Identifiers
| CAS Number | 52712-76-2 |
|---|---|
| SMILES | CCCC(=O)N1CCCN(CC1)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC.Cl |
| InChIKey | NBGBEUITCPENLJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bunazosin Hydrochloride (CAS 52712-76-2), with molecular formula C19H28ClN5O3 and molecular weight 409.19 g/mol. IUPAC: 1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)-1,4-diazepan-1-yl]butan-1-one;hydrochloride.
Chemical Property Profile of Bunazosin Hydrochloride
Property Insights of Bunazosin Hydrochloride
The XLogP value of 2.49 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bunazosin Hydrochloride. The TPSA of 93.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Bunazosin Hydrochloride. Following Lipinski's Rule of Five, Bunazosin Hydrochloride has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bunazosin Hydrochloride?
The CAS number of Bunazosin Hydrochloride is 52712-76-2.
What is the molecular formula of Bunazosin Hydrochloride?
The molecular formula of Bunazosin Hydrochloride is C19H28ClN5O3.
What is the molecular weight of Bunazosin Hydrochloride?
The molecular weight of Bunazosin Hydrochloride is 409.19 g/mol.
Where can I buy Bunazosin Hydrochloride?
You can request a quote for Bunazosin Hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bunazosin Hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Bunazosin Hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.