2-Azabicyclo(2.2.1)hept-5-en-3-one
TL;DR: 2-Azabicyclo(2.2.1)hept-5-en-3-one (CAS 61865-48-3) is a chemical compound with molecular formula C6H7NO and molecular weight 109.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-azabicyclo[2.2.1]hept-5-en-3-one
Also Known As: 2-Azabicyclo[2.2.1]hept-5-en-3-one, vince lactam, Vince-Lactam, 2-Abheo, Peramivir Impurity 26
| Molecular Formula | C6H7NO |
|---|---|
| Molecular Weight | 109.05 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 109.052765 |
| Heavy Atoms | 8 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 61865-48-3 |
|---|---|
| SMILES | C1C2C=CC1NC2=O |
| InChIKey | DDUFYKNOXPZZIW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Azabicyclo(2.2.1)hept-5-en-3-one (CAS 61865-48-3), with molecular formula C6H7NO and molecular weight 109.05 g/mol. IUPAC: 2-azabicyclo[2.2.1]hept-5-en-3-one.
Chemical Property Profile of 2-Azabicyclo(2.2.1)hept-5-en-3-one
Property Insights of 2-Azabicyclo(2.2.1)hept-5-en-3-one
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Azabicyclo(2.2.1)hept-5-en-3-one. With a topological polar surface area (TPSA) of 29.1 Ų, 2-Azabicyclo(2.2.1)hept-5-en-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Azabicyclo(2.2.1)hept-5-en-3-one 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-Azabicyclo(2.2.1)hept-5-en-3-one?
The CAS number of 2-Azabicyclo(2.2.1)hept-5-en-3-one is 61865-48-3.
What is the molecular formula of 2-Azabicyclo(2.2.1)hept-5-en-3-one?
The molecular formula of 2-Azabicyclo(2.2.1)hept-5-en-3-one is C6H7NO.
What is the molecular weight of 2-Azabicyclo(2.2.1)hept-5-en-3-one?
The molecular weight of 2-Azabicyclo(2.2.1)hept-5-en-3-one is 109.05 g/mol.
Where can I buy 2-Azabicyclo(2.2.1)hept-5-en-3-one?
You can request a quote for 2-Azabicyclo(2.2.1)hept-5-en-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Azabicyclo(2.2.1)hept-5-en-3-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Azabicyclo(2.2.1)hept-5-en-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.