布那唑嗪
TL;DR: 布那唑嗪 (CAS 80755-51-7) is a chemical compound with molecular formula C19H27N5O3 and molecular weight 373.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
布那唑嗪
1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)-1,4-diazepan-1-yl]butan-1-one
Also Known As: Bunazosin, Bunazosina, Bunazosine, Bunazosinum, bunazocine
| Molecular Formula | C19H27N5O3 |
|---|---|
| Molecular Weight | 373.21 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 93.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.2114 |
| Heavy Atoms | 27 |
| Complexity | 494.0 |
Chemical Identifiers
| CAS Number | 80755-51-7 |
|---|---|
| SMILES | CCCC(=O)N1CCCN(CC1)C2=NC3=CC(=C(C=C3C(=N2)N)OC)OC |
| InChIKey | RHLJLALHBZGAFM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
布那唑嗪 (CAS 80755-51-7), with molecular formula C19H27N5O3 and molecular weight 373.21 g/mol. IUPAC: 1-[4-(4-amino-6,7-dimethoxyquinazolin-2-yl)-1,4-diazepan-1-yl]butan-1-one.
Chemical Property Profile of 布那唑嗪
Property Insights of 布那唑嗪
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 布那唑嗪. The TPSA of 93.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 布那唑嗪. Following Lipinski's Rule of Five, 布那唑嗪 has 1 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 布那唑嗪?
The CAS number of 布那唑嗪 is 80755-51-7.
What is the molecular formula of 布那唑嗪?
The molecular formula of 布那唑嗪 is C19H27N5O3.
What is the molecular weight of 布那唑嗪?
The molecular weight of 布那唑嗪 is 373.21 g/mol.
Where can I buy 布那唑嗪?
You can request a quote for 布那唑嗪 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 布那唑嗪?
Yes, KEHONG BIO provides custom synthesis services for 布那唑嗪 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.