9-Azabicyclo(3.3.1)nonane, 3-beta-phenyl-9-benzyl-, hydrochloride
TL;DR: 9-Azabicyclo(3.3.1)nonane, 3-beta-phenyl-9-benzyl-, hydrochloride (CAS 2448-15-9) is a chemical compound with molecular formula C21H26ClN and molecular weight 327.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-benzyl-3-phenyl-9-azoniabicyclo[3.3.1]nonane chloride
Also Known As: 3-beta-Phenyl-9-benzyl-9-azabicyclo(3.3.1)nonane hydrochloride, 9-AZABICYCLO(3.3.1)NONANE, 3-beta-PHENYL-9-BENZYL-, HYDROCHLORIDE, 9-Benzyl-7-phenyl-9-azoniabicyclo[3.3.1]nonane chloride, 9-benzyl-3-phenyl-9-azoniabicyclo[3.3.1]nonane chloride, RefChem:312968
| Molecular Formula | C21H26ClN |
|---|---|
| Molecular Weight | 327.18 g/mol |
| LogP | 0.57 |
| Topological Polar Surface Area | 4.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 327.17538 |
| Heavy Atoms | 23 |
| Complexity | 326.0 |
Chemical Identifiers
| CAS Number | 2448-15-9 |
|---|---|
| SMILES | C1CC2CC(CC(C1)[NH+]2CC3=CC=CC=C3)C4=CC=CC=C4.[Cl-] |
| InChIKey | SDFIBMNXLKMSSV-UHFFFAOYSA-N |
Product Overview
9-Azabicyclo(3.3.1)nonane, 3-beta-phenyl-9-benzyl-, hydrochloride (CAS 2448-15-9), with molecular formula C21H26ClN and molecular weight 327.18 g/mol. IUPAC: 9-benzyl-3-phenyl-9-azoniabicyclo[3.3.1]nonane chloride.
Chemical Property Profile of 9-Azabicyclo(3.3.1)nonane, 3-beta-phenyl-9-benzyl-, hydrochloride
Property Insights of 9-Azabicyclo(3.3.1)nonane, 3-beta-phenyl-9-benzyl-, hydrochloride
The XLogP value of 0.57 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-Azabicyclo(3.3.1)nonane, 3-beta-phenyl-9-benzyl-, hydrochloride. With a topological polar surface area (TPSA) of 4.4 Ų, 9-Azabicyclo(3.3.1)nonane, 3-beta-phenyl-9-benzyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Azabicyclo(3.3.1)nonane, 3-beta-phenyl-9-benzyl-, hydrochloride has 1 hydrogen bond donor(s) and 1 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 9-Azabicyclo(3.3.1)nonane, 3-beta-phenyl-9-benzyl-, hydrochloride?
The CAS number of 9-Azabicyclo(3.3.1)nonane, 3-beta-phenyl-9-benzyl-, hydrochloride is 2448-15-9.
What is the molecular formula of 9-Azabicyclo(3.3.1)nonane, 3-beta-phenyl-9-benzyl-, hydrochloride?
The molecular formula of 9-Azabicyclo(3.3.1)nonane, 3-beta-phenyl-9-benzyl-, hydrochloride is C21H26ClN.
What is the molecular weight of 9-Azabicyclo(3.3.1)nonane, 3-beta-phenyl-9-benzyl-, hydrochloride?
The molecular weight of 9-Azabicyclo(3.3.1)nonane, 3-beta-phenyl-9-benzyl-, hydrochloride is 327.18 g/mol.
Where can I buy 9-Azabicyclo(3.3.1)nonane, 3-beta-phenyl-9-benzyl-, hydrochloride?
You can request a quote for 9-Azabicyclo(3.3.1)nonane, 3-beta-phenyl-9-benzyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Azabicyclo(3.3.1)nonane, 3-beta-phenyl-9-benzyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 9-Azabicyclo(3.3.1)nonane, 3-beta-phenyl-9-benzyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.