Saclofen
TL;DR: Saclofen (CAS 125464-42-8) is a chemical compound with molecular formula C9H12ClNO3S and molecular weight 249.02264 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-amino-2-(4-chlorophenyl)propane-1-sulfonic acid
Also Known As: saclofen, 3-amino-2-(4-chlorophenyl)propane-1-sulfonic acid, Saclofen, solid, Saclofen?, Saclofen HCl
Application Areas
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H12ClNO3S |
| Molecular Weight | 249.02264 g/mol |
| XLogP | -1.7 |
| Topological Polar Surface Area (TPSA) | 88.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 249.02264 Da |
| Heavy Atoms | 15 |
| Complexity | 280.0 |
| SMILES | C1=CC(=CC=C1C(CN)CS(=O)(=O)O)Cl |
| InChIKey | JYLNVJYYQQXNEK-UHFFFAOYSA-N |
Chemical Property Profile of Saclofen
Property Insights of Saclofen
The XLogP value of -1.7 indicates that Saclofen is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 88.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Saclofen. Following Lipinski's Rule of Five, Saclofen has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Saclofen?
The CAS number of Saclofen is 125464-42-8.
What is the molecular formula of Saclofen?
The molecular formula of Saclofen is C9H12ClNO3S.
What is the molecular weight of Saclofen?
The molecular weight of Saclofen is 249.02264 g/mol.
Where can I buy Saclofen?
You can request a quote for Saclofen directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Saclofen?
Yes, CoreyChem provides custom synthesis services for Saclofen and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.