Sitalidone
TL;DR: Sitalidone (CAS 119636-74-7) is a chemical compound with molecular formula C23H29ClN2O5S and molecular weight 480.14856 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-N-[4-hydroxy-3,5-di(propan-2-yl)phenyl]-5-(2-hydroxy-1-methyl-5-oxopyrrolidin-2-yl)benzenesulfonamide
Also Known As: Sitalidone, sitalidona, Sitalidone [INN], sitalidonum, 9beta-Hydroxymerulidial
Technical Specifications
| Molecular Formula | C23H29ClN2O5S |
| Molecular Weight | 480.14856 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 115.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 480.14856 Da |
| Heavy Atoms | 32 |
| Complexity | 768.0 |
| SMILES | CC(C)C1=CC(=CC(=C1O)C(C)C)NS(=O)(=O)C2=C(C=CC(=C2)C3(CCC(=O)N3C)O)Cl |
| InChIKey | PGKMOQNZLQCYGZ-UHFFFAOYSA-N |
Chemical Property Profile of Sitalidone
Property Insights of Sitalidone
The XLogP value of 3.6 indicates that Sitalidone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Sitalidone. Following Lipinski's Rule of Five, Sitalidone has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Sitalidone?
The CAS number of Sitalidone is 119636-74-7.
What is the molecular formula of Sitalidone?
The molecular formula of Sitalidone is C23H29ClN2O5S.
What is the molecular weight of Sitalidone?
The molecular weight of Sitalidone is 480.14856 g/mol.
Where can I buy Sitalidone?
You can request a quote for Sitalidone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Sitalidone?
Yes, CoreyChem provides custom synthesis services for Sitalidone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.