2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one
TL;DR: 2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one (CAS 103660-34-0) is a chemical compound with molecular formula C18H17NO and molecular weight 263.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(naphthalen-1-ylmethylidene)-1-azabicyclo[2.2.2]octan-3-one
Also Known As: Maybridge1_005537, DivK1c_001825, CDS1_000785, 2-[(Z)-1-naphthylmethylidene]-3-quinuclidinone, 2-(1-naphthylmethylene)quinuclidin-3-one
| Molecular Formula | C18H17NO |
|---|---|
| Molecular Weight | 263.13 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 263.131 |
| Heavy Atoms | 20 |
| Complexity | 419.0 |
Chemical Identifiers
| CAS Number | 103660-34-0 |
|---|---|
| SMILES | C1CN2CCC1C(=O)C2=CC3=CC=CC4=CC=CC=C43 |
| InChIKey | AJHSKARRJJFMLZ-UHFFFAOYSA-N |
Product Overview
2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one (CAS 103660-34-0), with molecular formula C18H17NO and molecular weight 263.13 g/mol. IUPAC: 2-(naphthalen-1-ylmethylidene)-1-azabicyclo[2.2.2]octan-3-one.
Chemical Property Profile of 2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one
Property Insights of 2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one
The XLogP value of 3.9 indicates that 2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]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 2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one?
The CAS number of 2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one is 103660-34-0.
What is the molecular formula of 2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one?
The molecular formula of 2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one is C18H17NO.
What is the molecular weight of 2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one?
The molecular weight of 2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one is 263.13 g/mol.
Where can I buy 2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one?
You can request a quote for 2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]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 2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one?
Yes, KEHONG BIO provides custom synthesis services for 2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.