1-phenyl-1H-azepine
TL;DR: 1-phenyl-1H-azepine (CAS 32676-16-7) is a chemical compound with molecular formula C12H11N and molecular weight 169.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenylazepine
Also Known As: 1-phenyl-1H-azepine, 1-phenylazepine, 1H-Azepine, 1-phenyl-, RefChem:233049
| Molecular Formula | C12H11N |
|---|---|
| Molecular Weight | 169.09 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 169.08914 |
| Heavy Atoms | 13 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 32676-16-7 |
|---|---|
| SMILES | C1=CC=CN(C=C1)C2=CC=CC=C2 |
| InChIKey | LGQKWCHXQUKUMT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-phenyl-1H-azepine (CAS 32676-16-7), with molecular formula C12H11N and molecular weight 169.09 g/mol. IUPAC: 1-phenylazepine.
Chemical Property Profile of 1-phenyl-1H-azepine
Property Insights of 1-phenyl-1H-azepine
The XLogP value of 3.4 indicates that 1-phenyl-1H-azepine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, 1-phenyl-1H-azepine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-phenyl-1H-azepine 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-phenyl-1H-azepine?
The CAS number of 1-phenyl-1H-azepine is 32676-16-7.
What is the molecular formula of 1-phenyl-1H-azepine?
The molecular formula of 1-phenyl-1H-azepine is C12H11N.
What is the molecular weight of 1-phenyl-1H-azepine?
The molecular weight of 1-phenyl-1H-azepine is 169.09 g/mol.
Where can I buy 1-phenyl-1H-azepine?
You can request a quote for 1-phenyl-1H-azepine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-phenyl-1H-azepine?
Yes, KEHONG BIO provides custom synthesis services for 1-phenyl-1H-azepine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.