![3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1] octane structure](/static/products/395/395059-35-5.png)
3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1] octane
TL;DR: 3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1] octane (CAS 395059-35-5) is a chemical compound with molecular formula C12H15ClN2 and molecular weight 222.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-3,8-diazabicyclo[3.2.1]octane
Also Known As: 3-(4-chlorophenyl)-3,8-diazabicyclo[3.2.1]octane, 3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1] octane
| Molecular Formula | C12H15ClN2 |
|---|---|
| Molecular Weight | 222.09 g/mol |
| LogP | 2.2806 |
| Topological Polar Surface Area | 15.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.09238 |
| Heavy Atoms | 15 |
| Complexity | 337.14468 |
Chemical Identifiers
| CAS Number | 395059-35-5 |
|---|---|
| SMILES | C1CC2CN(CC1N2)C3=CC=C(C=C3)Cl |
Product Overview
3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1] octane (CAS 395059-35-5), with molecular formula C12H15ClN2 and molecular weight 222.09 g/mol. IUPAC: 3-(4-chlorophenyl)-3,8-diazabicyclo[3.2.1]octane.
Chemical Property Profile of 3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1] octane
Property Insights of 3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1] octane
The XLogP value of 2.2806 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1] octane. With a topological polar surface area (TPSA) of 15.27 Ų, 3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1] octane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1] octane has 1 hydrogen bond donor(s) and 2 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 3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1] octane?
The CAS number of 3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1] octane is 395059-35-5.
What is the molecular formula of 3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1] octane?
The molecular formula of 3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1] octane is C12H15ClN2.
What is the molecular weight of 3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1] octane?
The molecular weight of 3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1] octane is 222.09 g/mol.
Where can I buy 3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1] octane?
You can request a quote for 3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1] octane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1] octane?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Chloro-phenyl)-3,8-diaza-bicyclo[3.2.1] octane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.