![3-(4-Chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane structure](/static/products/395/395059-45-7.png)
3-(4-Chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane
TL;DR: 3-(4-Chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane (CAS 395059-45-7) is a chemical compound with molecular formula C13H17ClN2 and molecular weight 236.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane
Also Known As: 3-(4-chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane
| Molecular Formula | C13H17ClN2 |
|---|---|
| Molecular Weight | 236.11 g/mol |
| LogP | 2.6228 |
| Topological Polar Surface Area | 6.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 236.10803 |
| Heavy Atoms | 16 |
| Complexity | 362.02393 |
Chemical Identifiers
| CAS Number | 395059-45-7 |
|---|---|
| SMILES | CN1C2CCC1CN(C2)C3=CC=C(C=C3)Cl |
Product Overview
3-(4-Chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane (CAS 395059-45-7), with molecular formula C13H17ClN2 and molecular weight 236.11 g/mol. IUPAC: 3-(4-chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane.
Chemical Property Profile of 3-(4-Chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane
Property Insights of 3-(4-Chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane
The XLogP value of 2.6228 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane. With a topological polar surface area (TPSA) of 6.48 Ų, 3-(4-Chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane has 0 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-Chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane?
The CAS number of 3-(4-Chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane is 395059-45-7.
What is the molecular formula of 3-(4-Chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane?
The molecular formula of 3-(4-Chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane is C13H17ClN2.
What is the molecular weight of 3-(4-Chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane?
The molecular weight of 3-(4-Chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane is 236.11 g/mol.
Where can I buy 3-(4-Chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane?
You can request a quote for 3-(4-Chlorophenyl)-8-methyl-3,8-diazabicyclo[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-Chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Chlorophenyl)-8-methyl-3,8-diazabicyclo[3.2.1]octane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.