![2,4-Bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one structure](/static/products/6571/65712-49-4.webp)
2,4-Bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one
TL;DR: 2,4-Bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one (CAS 65712-49-4) is a chemical compound with molecular formula C22H25NO and molecular weight 319.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one
Also Known As: 2,4-bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one, J1.435.241D, 2,4-Bis(o-tolyl)-3-azabicyclo[3.3.1]nonane-9-one
| Molecular Formula | C22H25NO |
|---|---|
| Molecular Weight | 319.19 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 319.1936 |
| Heavy Atoms | 24 |
| Complexity | 423.0 |
Chemical Identifiers
| CAS Number | 65712-49-4 |
|---|---|
| SMILES | CC1=CC=CC=C1C2C3CCCC(C3=O)C(N2)C4=CC=CC=C4C |
| InChIKey | YFNYBSBZZJUXHR-UHFFFAOYSA-N |
Product Overview
2,4-Bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one (CAS 65712-49-4), with molecular formula C22H25NO and molecular weight 319.19 g/mol. IUPAC: 2,4-bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one.
Chemical Property Profile of 2,4-Bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one
Property Insights of 2,4-Bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one
The XLogP value of 4.1 indicates that 2,4-Bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 2,4-Bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one has 1 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 2,4-Bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one?
The CAS number of 2,4-Bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one is 65712-49-4.
What is the molecular formula of 2,4-Bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one?
The molecular formula of 2,4-Bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one is C22H25NO.
What is the molecular weight of 2,4-Bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one?
The molecular weight of 2,4-Bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one is 319.19 g/mol.
Where can I buy 2,4-Bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one?
You can request a quote for 2,4-Bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Bis(2-methylphenyl)-3-azabicyclo[3.3.1]nonan-9-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.