2-Benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-3-one
TL;DR: 2-Benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-3-one (CAS 7236-10-4) is a chemical compound with molecular formula C20H20INO2 and molecular weight 433.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-3-one
Also Known As: 2-Benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-3-one, 3-benzyl-5-(2-iodo-4-methylphenoxy)-3-azabicyclo[2.2.1]heptan-2-one, 6-benzyl-2-(2-iodo-4-methyl-phenoxy)-6-azabicyclo[2.2.1]heptan-5-one
| Molecular Formula | C20H20INO2 |
|---|---|
| Molecular Weight | 433.05 g/mol |
| LogP | 4.16802 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 433.0539 |
| Heavy Atoms | 24 |
| Complexity | 761.4891 |
Chemical Identifiers
| CAS Number | 7236-10-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)OC2CC3CC2N(C3=O)CC4=CC=CC=C4)I |
Product Overview
2-Benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-3-one (CAS 7236-10-4), with molecular formula C20H20INO2 and molecular weight 433.05 g/mol. IUPAC: 2-benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-3-one.
Chemical Property Profile of 2-Benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-3-one
Property Insights of 2-Benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-3-one
The XLogP value of 4.16802 indicates that 2-Benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, 2-Benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-3-one has 0 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-Benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-3-one?
The CAS number of 2-Benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-3-one is 7236-10-4.
What is the molecular formula of 2-Benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-3-one?
The molecular formula of 2-Benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-3-one is C20H20INO2.
What is the molecular weight of 2-Benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-3-one?
The molecular weight of 2-Benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-3-one is 433.05 g/mol.
Where can I buy 2-Benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-3-one?
You can request a quote for 2-Benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-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-Benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-3-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzyl-6-(2-iodo-4-methylphenoxy)-2-azabicyclo[2.2.1]heptan-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.