Azocan-1-yl-(3,4-dimethoxyphenyl)methanone
TL;DR: Azocan-1-yl-(3,4-dimethoxyphenyl)methanone (CAS 898136-37-3) is a chemical compound with molecular formula C16H23NO3 and molecular weight 277.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azocan-1-yl-(3,4-dimethoxyphenyl)methanone
Also Known As: azocan-1-yl-(3,4-dimethoxyphenyl)methanone, azocan-1-yl(3,4-dimethoxyphenyl)methanone, azaperhydroocinyl 3,4-dimethoxyphenyl ketone
| Molecular Formula | C16H23NO3 |
|---|---|
| Molecular Weight | 277.17 g/mol |
| LogP | 3.1101 |
| Topological Polar Surface Area | 38.77 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 277.1678 |
| Heavy Atoms | 20 |
| Complexity | 451.03525 |
Chemical Identifiers
| CAS Number | 898136-37-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(=O)N2CCCCCCC2)OC |
Product Overview
Azocan-1-yl-(3,4-dimethoxyphenyl)methanone (CAS 898136-37-3), with molecular formula C16H23NO3 and molecular weight 277.17 g/mol. IUPAC: azocan-1-yl-(3,4-dimethoxyphenyl)methanone.
Chemical Property Profile of Azocan-1-yl-(3,4-dimethoxyphenyl)methanone
Property Insights of Azocan-1-yl-(3,4-dimethoxyphenyl)methanone
The XLogP value of 3.1101 indicates that Azocan-1-yl-(3,4-dimethoxyphenyl)methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.77 Ų, Azocan-1-yl-(3,4-dimethoxyphenyl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Azocan-1-yl-(3,4-dimethoxyphenyl)methanone has 0 hydrogen bond donor(s) and 3 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 Azocan-1-yl-(3,4-dimethoxyphenyl)methanone?
The CAS number of Azocan-1-yl-(3,4-dimethoxyphenyl)methanone is 898136-37-3.
What is the molecular formula of Azocan-1-yl-(3,4-dimethoxyphenyl)methanone?
The molecular formula of Azocan-1-yl-(3,4-dimethoxyphenyl)methanone is C16H23NO3.
What is the molecular weight of Azocan-1-yl-(3,4-dimethoxyphenyl)methanone?
The molecular weight of Azocan-1-yl-(3,4-dimethoxyphenyl)methanone is 277.17 g/mol.
Where can I buy Azocan-1-yl-(3,4-dimethoxyphenyl)methanone?
You can request a quote for Azocan-1-yl-(3,4-dimethoxyphenyl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Azocan-1-yl-(3,4-dimethoxyphenyl)methanone?
Yes, KEHONG BIO provides custom synthesis services for Azocan-1-yl-(3,4-dimethoxyphenyl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.