![2-[(4-Methoxyphenyl)methyl]azepane structure](/static/products/6884/68841-06-5.webp)
2-[(4-Methoxyphenyl)methyl]azepane
TL;DR: 2-[(4-Methoxyphenyl)methyl]azepane (CAS 68841-06-5) is a chemical compound with molecular formula C14H21NO and molecular weight 219.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-methoxyphenyl)methyl]azepane
Also Known As: 2-(4-methoxybenzyl)azepane, 2-[(4-methoxyphenyl)methyl]azepane, HEXAHYDRO-2-[(4-METHOXYLPHENYL)METHYL]-1H-AZEPINE, 2-(Trimethylsilyl)furo[3,2-b]pyridine-6-carbaldehydeoxime
| Molecular Formula | C14H21NO |
|---|---|
| Molecular Weight | 219.16 g/mol |
| LogP | 2.7699 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 219.16231 |
| Heavy Atoms | 16 |
| Complexity | 299.0163 |
Chemical Identifiers
| CAS Number | 68841-06-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CC2CCCCCN2 |
Product Overview
2-[(4-Methoxyphenyl)methyl]azepane (CAS 68841-06-5), with molecular formula C14H21NO and molecular weight 219.16 g/mol. IUPAC: 2-[(4-methoxyphenyl)methyl]azepane.
Chemical Property Profile of 2-[(4-Methoxyphenyl)methyl]azepane
Property Insights of 2-[(4-Methoxyphenyl)methyl]azepane
The XLogP value of 2.7699 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(4-Methoxyphenyl)methyl]azepane. With a topological polar surface area (TPSA) of 21.26 Ų, 2-[(4-Methoxyphenyl)methyl]azepane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(4-Methoxyphenyl)methyl]azepane 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 2-[(4-Methoxyphenyl)methyl]azepane?
The CAS number of 2-[(4-Methoxyphenyl)methyl]azepane is 68841-06-5.
What is the molecular formula of 2-[(4-Methoxyphenyl)methyl]azepane?
The molecular formula of 2-[(4-Methoxyphenyl)methyl]azepane is C14H21NO.
What is the molecular weight of 2-[(4-Methoxyphenyl)methyl]azepane?
The molecular weight of 2-[(4-Methoxyphenyl)methyl]azepane is 219.16 g/mol.
Where can I buy 2-[(4-Methoxyphenyl)methyl]azepane?
You can request a quote for 2-[(4-Methoxyphenyl)methyl]azepane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(4-Methoxyphenyl)methyl]azepane?
Yes, KEHONG BIO provides custom synthesis services for 2-[(4-Methoxyphenyl)methyl]azepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.