2-Phenylazepane
TL;DR: 2-Phenylazepane (CAS 3466-83-9) is a chemical compound with molecular formula C12H17N and molecular weight 175.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenylazepane
Also Known As: 2-phenylazepane, 2-Phenyl-azepane, 2-Phenylperhydroazepine, 2-Phenylazepane HCl, 2-phenylazacycloheptane
| Molecular Formula | C12H17N |
|---|---|
| Molecular Weight | 175.14 g/mol |
| LogP | 2.8913 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 175.1361 |
| Heavy Atoms | 13 |
| Complexity | 234.5612 |
Chemical Identifiers
| CAS Number | 3466-83-9 |
|---|---|
| SMILES | C1CCC(NCC1)C2=CC=CC=C2 |
Product Overview
2-Phenylazepane (CAS 3466-83-9), with molecular formula C12H17N and molecular weight 175.14 g/mol. IUPAC: 2-phenylazepane.
Chemical Property Profile of 2-Phenylazepane
Property Insights of 2-Phenylazepane
The XLogP value of 2.8913 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Phenylazepane. With a topological polar surface area (TPSA) of 12.03 Ų, 2-Phenylazepane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Phenylazepane has 1 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 2-Phenylazepane?
The CAS number of 2-Phenylazepane is 3466-83-9.
What is the molecular formula of 2-Phenylazepane?
The molecular formula of 2-Phenylazepane is C12H17N.
What is the molecular weight of 2-Phenylazepane?
The molecular weight of 2-Phenylazepane is 175.14 g/mol.
Where can I buy 2-Phenylazepane?
You can request a quote for 2-Phenylazepane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Phenylazepane?
Yes, KEHONG BIO provides custom synthesis services for 2-Phenylazepane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.