(S)-Aceclidine
TL;DR: (S)-Aceclidine (CAS 59653-42-8) is a chemical compound with molecular formula C9H15NO2 and molecular weight 169.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3S)-1-azabicyclo[2.2.2]octan-3-yl] acetate
Also Known As: (-)-aceclidine, (S)-ACECLIDINE, Aceclidine, (S)-, (+)-aceclidine, (S)-3-Acetoxyquinuclidine
| Molecular Formula | C9H15NO2 |
|---|---|
| Molecular Weight | 169.11 g/mol |
| LogP | 0.6437 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 169.11028 |
| Heavy Atoms | 12 |
| Complexity | 184.96756 |
Chemical Identifiers
| CAS Number | 59653-42-8 |
|---|---|
| SMILES | CC(=O)O[C@@H]1CN2CCC1CC2 |
Product Overview
(S)-Aceclidine (CAS 59653-42-8), with molecular formula C9H15NO2 and molecular weight 169.11 g/mol. IUPAC: [(3S)-1-azabicyclo[2.2.2]octan-3-yl] acetate.
Chemical Property Profile of (S)-Aceclidine
Property Insights of (S)-Aceclidine
The XLogP value of 0.6437 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-Aceclidine. With a topological polar surface area (TPSA) of 29.54 Ų, (S)-Aceclidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-Aceclidine has 0 hydrogen bond donor(s) and 3 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 (S)-Aceclidine?
The CAS number of (S)-Aceclidine is 59653-42-8.
What is the molecular formula of (S)-Aceclidine?
The molecular formula of (S)-Aceclidine is C9H15NO2.
What is the molecular weight of (S)-Aceclidine?
The molecular weight of (S)-Aceclidine is 169.11 g/mol.
Where can I buy (S)-Aceclidine?
You can request a quote for (S)-Aceclidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-Aceclidine?
Yes, KEHONG BIO provides custom synthesis services for (S)-Aceclidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.