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2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one structure
Fine Chemical

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 263.131 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

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

CAS Number
103660-34-0
Molecular Formula
C18H17NO
Molecular Weight
263.131 g/mol
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Technical Specifications

Molecular FormulaC18H17NO
Molecular Weight263.131 g/mol
XLogP3.9
Topological Polar Surface Area (TPSA)20.3 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds1
Exact Mass263.131 Da
Heavy Atoms20
Complexity419.0
SMILESC1CN2CCC1C(=O)C2=CC3=CC=CC4=CC=CC=C43
InChIKeyAJHSKARRJJFMLZ-UHFFFAOYSA-N

Chemical Property Profile of 2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one

XLogP
3.9
TPSA (Topological Polar Surface Area)
20.3
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
1
Heavy Atoms
20
Complexity
419.0
Exact Mass
263.131
Monoisotopic Mass
263.131
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

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

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 263.131 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 CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-[(Naphthalen-1-yl)methylidene]-1-azabicyclo[2.2.2]octan-3-one?

Yes, CoreyChem 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.

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