N-Phenethylazetidine
TL;DR: N-Phenethylazetidine (CAS 42525-65-5) is a chemical compound with molecular formula C11H15N and molecular weight 161.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-phenylethyl)azetidine
Also Known As: N-Phenethylazetidine, 1-phenethylazetidine, 1-(2-phenylethyl)azetidine, RefChem:364728
| Molecular Formula | C11H15N |
|---|---|
| Molecular Weight | 161.12 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 161.12045 |
| Heavy Atoms | 12 |
| Complexity | 123.0 |
Chemical Identifiers
| CAS Number | 42525-65-5 |
|---|---|
| SMILES | C1CN(C1)CCC2=CC=CC=C2 |
| InChIKey | VIXGVWUHPTYYAH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Phenethylazetidine (CAS 42525-65-5), with molecular formula C11H15N and molecular weight 161.12 g/mol. IUPAC: 1-(2-phenylethyl)azetidine.
Chemical Property Profile of N-Phenethylazetidine
Property Insights of N-Phenethylazetidine
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Phenethylazetidine. With a topological polar surface area (TPSA) of 3.2 Ų, N-Phenethylazetidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Phenethylazetidine 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 N-Phenethylazetidine?
The CAS number of N-Phenethylazetidine is 42525-65-5.
What is the molecular formula of N-Phenethylazetidine?
The molecular formula of N-Phenethylazetidine is C11H15N.
What is the molecular weight of N-Phenethylazetidine?
The molecular weight of N-Phenethylazetidine is 161.12 g/mol.
Where can I buy N-Phenethylazetidine?
You can request a quote for N-Phenethylazetidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Phenethylazetidine?
Yes, KEHONG BIO provides custom synthesis services for N-Phenethylazetidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.