![Ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate structure](/static/products/3794/37943-62-7.webp)
Ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate
TL;DR: Ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate (CAS 37943-62-7) is a chemical compound with molecular formula C18H21NO4 and molecular weight 315.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate
Also Known As: ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate, AF-399/25108033, 3-Benzoyl-9-oxo-3-aza-bicyclo[3.3.1]nonane-7-carboxylic acid ethyl ester, ethyl 9-oxo-3-(phenylcarbonyl)-3-azabicyclo[3.3.1]nonane-7-carboxylate, ethyl 9-oxo-7-(phenylcarbonyl)-7-azabicyclo[3.3.1]nonane-3-carboxylate
| Molecular Formula | C18H21NO4 |
|---|---|
| Molecular Weight | 315.15 g/mol |
| LogP | 1.917 |
| Topological Polar Surface Area | 63.68 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 315.14706 |
| Heavy Atoms | 23 |
| Complexity | 594.7074 |
Chemical Identifiers
| CAS Number | 37943-62-7 |
|---|---|
| SMILES | CCOC(=O)C1CC2CN(CC(C1)C2=O)C(=O)C3=CC=CC=C3 |
Product Overview
Ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate (CAS 37943-62-7), with molecular formula C18H21NO4 and molecular weight 315.15 g/mol. IUPAC: ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate.
Chemical Property Profile of Ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate
Property Insights of Ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate
The XLogP value of 1.917 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate. The TPSA of 63.68 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate. Following Lipinski's Rule of Five, Ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate has 0 hydrogen bond donor(s) and 4 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 Ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate?
The CAS number of Ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate is 37943-62-7.
What is the molecular formula of Ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate?
The molecular formula of Ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate is C18H21NO4.
What is the molecular weight of Ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate?
The molecular weight of Ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate is 315.15 g/mol.
Where can I buy Ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate?
You can request a quote for Ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-benzoyl-9-oxo-3-azabicyclo[3.3.1]nonane-7-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.