1-Benzoylazocane
TL;DR: 1-Benzoylazocane (CAS 17721-46-9) is a chemical compound with molecular formula C14H19NO and molecular weight 217.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azocan-1-yl(phenyl)methanone
Also Known As: 1-benzoylazocane, azocan-1-yl(phenyl)methanone, Azocine, 1-benzoyloctahydro-, Azocan-1-yl-phenyl-methanone, (Azocan-1-yl)(phenyl)methanone
| Molecular Formula | C14H19NO |
|---|---|
| Molecular Weight | 217.15 g/mol |
| LogP | 3.0929 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 217.14667 |
| Heavy Atoms | 16 |
| Complexity | 325.8484 |
Chemical Identifiers
| CAS Number | 17721-46-9 |
|---|---|
| SMILES | C1CCCN(CCC1)C(=O)C2=CC=CC=C2 |
Product Overview
1-Benzoylazocane (CAS 17721-46-9), with molecular formula C14H19NO and molecular weight 217.15 g/mol. IUPAC: azocan-1-yl(phenyl)methanone.
Chemical Property Profile of 1-Benzoylazocane
Property Insights of 1-Benzoylazocane
The XLogP value of 3.0929 indicates that 1-Benzoylazocane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.31 Ų, 1-Benzoylazocane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzoylazocane has 0 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 1-Benzoylazocane?
The CAS number of 1-Benzoylazocane is 17721-46-9.
What is the molecular formula of 1-Benzoylazocane?
The molecular formula of 1-Benzoylazocane is C14H19NO.
What is the molecular weight of 1-Benzoylazocane?
The molecular weight of 1-Benzoylazocane is 217.15 g/mol.
Where can I buy 1-Benzoylazocane?
You can request a quote for 1-Benzoylazocane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzoylazocane?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzoylazocane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.