8-Benzyl-8-azabicyclo(3.2.1)octan-3-one
TL;DR: 8-Benzyl-8-azabicyclo(3.2.1)octan-3-one (CAS 28957-72-4) is a chemical compound with molecular formula C14H17NO and molecular weight 215.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-benzyl-8-azabicyclo[3.2.1]octan-3-one
Also Known As: 8-benzyl-8-azabicyclo[3.2.1]octan-3-one, N-benzyltropinone, N-Benzylnortropinone, n-benzyl tropinone, N-Benzyl Nortropinone
| Molecular Formula | C14H17NO |
|---|---|
| Molecular Weight | 215.13 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 215.13101 |
| Heavy Atoms | 16 |
| Complexity | 254.0 |
Chemical Identifiers
| CAS Number | 28957-72-4 |
|---|---|
| SMILES | C1CC2CC(=O)CC1N2CC3=CC=CC=C3 |
| InChIKey | RSUHKGOVXMXCND-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
8-Benzyl-8-azabicyclo(3.2.1)octan-3-one (CAS 28957-72-4), with molecular formula C14H17NO and molecular weight 215.13 g/mol. IUPAC: 8-benzyl-8-azabicyclo[3.2.1]octan-3-one.
Chemical Property Profile of 8-Benzyl-8-azabicyclo(3.2.1)octan-3-one
Property Insights of 8-Benzyl-8-azabicyclo(3.2.1)octan-3-one
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Benzyl-8-azabicyclo(3.2.1)octan-3-one. With a topological polar surface area (TPSA) of 20.3 Ų, 8-Benzyl-8-azabicyclo(3.2.1)octan-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8-Benzyl-8-azabicyclo(3.2.1)octan-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 8-Benzyl-8-azabicyclo(3.2.1)octan-3-one?
The CAS number of 8-Benzyl-8-azabicyclo(3.2.1)octan-3-one is 28957-72-4.
What is the molecular formula of 8-Benzyl-8-azabicyclo(3.2.1)octan-3-one?
The molecular formula of 8-Benzyl-8-azabicyclo(3.2.1)octan-3-one is C14H17NO.
What is the molecular weight of 8-Benzyl-8-azabicyclo(3.2.1)octan-3-one?
The molecular weight of 8-Benzyl-8-azabicyclo(3.2.1)octan-3-one is 215.13 g/mol.
Where can I buy 8-Benzyl-8-azabicyclo(3.2.1)octan-3-one?
You can request a quote for 8-Benzyl-8-azabicyclo(3.2.1)octan-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Benzyl-8-azabicyclo(3.2.1)octan-3-one?
Yes, KEHONG BIO provides custom synthesis services for 8-Benzyl-8-azabicyclo(3.2.1)octan-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.