美他沙酮
TL;DR: 美他沙酮 (CAS 1665-48-1) is a chemical compound with molecular formula C12H15NO3 and molecular weight 221.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
美他沙酮
5-[(3,5-dimethylphenoxy)methyl]-1,3-oxazolidin-2-one
Also Known As: Skelaxin, Zorane, Methaxalonum, Methoxolone, Metaxalon
| Molecular Formula | C12H15NO3 |
|---|---|
| Molecular Weight | 221.11 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 221.1052 |
| Heavy Atoms | 16 |
| Complexity | 247.0 |
| Melting Point | 122 |
| Boiling Point | BP: 223 °C at 1.5 mm Hg |
| Solubility | Freely soluble in chloroform; soluble in methanol and 95% ethanol; practically insoluble in ether |
Chemical Identifiers
| CAS Number | 1665-48-1 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)OCC2CNC(=O)O2)C |
| InChIKey | IMWZZHHPURKASS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
美他沙酮 (CAS 1665-48-1), with molecular formula C12H15NO3 and molecular weight 221.11 g/mol. IUPAC: 5-[(3,5-dimethylphenoxy)methyl]-1,3-oxazolidin-2-one.
Chemical Property Profile of 美他沙酮
Property Insights of 美他沙酮
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 美他沙酮. With a topological polar surface area (TPSA) of 47.6 Ų, 美他沙酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 美他沙酮 has 1 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 美他沙酮?
The CAS number of 美他沙酮 is 1665-48-1.
What is the molecular formula of 美他沙酮?
The molecular formula of 美他沙酮 is C12H15NO3.
What is the molecular weight of 美他沙酮?
The molecular weight of 美他沙酮 is 221.11 g/mol.
Where can I buy 美他沙酮?
You can request a quote for 美他沙酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 美他沙酮?
Yes, KEHONG BIO provides custom synthesis services for 美他沙酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.