1-(Azepan-1-yl)octan-1-one
TL;DR: 1-(Azepan-1-yl)octan-1-one (CAS 18494-58-1) is a chemical compound with molecular formula C14H27NO and molecular weight 225.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(azepan-1-yl)octan-1-one
Also Known As: 1-(azepan-1-yl)octan-1-one, Hexamethyleneoctanamide, 1-Octanoyl-hexahydro-azepin, 1-octanoylhexahydro-1H-azepine, KST-1B1708
| Molecular Formula | C14H27NO |
|---|---|
| Molecular Weight | 225.21 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 225.20926 |
| Heavy Atoms | 16 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 18494-58-1 |
|---|---|
| SMILES | CCCCCCCC(=O)N1CCCCCC1 |
| InChIKey | AHPMSOZQRIEVLQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(Azepan-1-yl)octan-1-one (CAS 18494-58-1), with molecular formula C14H27NO and molecular weight 225.21 g/mol. IUPAC: 1-(azepan-1-yl)octan-1-one.
Chemical Property Profile of 1-(Azepan-1-yl)octan-1-one
Property Insights of 1-(Azepan-1-yl)octan-1-one
The XLogP value of 3.9 indicates that 1-(Azepan-1-yl)octan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 1-(Azepan-1-yl)octan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Azepan-1-yl)octan-1-one 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-(Azepan-1-yl)octan-1-one?
The CAS number of 1-(Azepan-1-yl)octan-1-one is 18494-58-1.
What is the molecular formula of 1-(Azepan-1-yl)octan-1-one?
The molecular formula of 1-(Azepan-1-yl)octan-1-one is C14H27NO.
What is the molecular weight of 1-(Azepan-1-yl)octan-1-one?
The molecular weight of 1-(Azepan-1-yl)octan-1-one is 225.21 g/mol.
Where can I buy 1-(Azepan-1-yl)octan-1-one?
You can request a quote for 1-(Azepan-1-yl)octan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Azepan-1-yl)octan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(Azepan-1-yl)octan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.