RefChem:118558
TL;DR: RefChem:118558 (CAS 63816-17-1) is a chemical compound with molecular formula C15H20INOSSe and molecular weight 468.94754 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-ethyl-5-methoxy-2-(2-methylsulfanylbut-1-enyl)-1,3-benzoselenazol-3-ium iodide
Also Known As: Benzoselenazolium, 3-ethyl-5-methoxy-2-(2-methylthio)-1-butenyl)-, iodide, Benzoselenazolium, 3-ethyl-5-methoxy-2-[2-(methylthio)-1-butenyl]-, iodide, Benzoselenazolium, 3-ethyl-5-methoxy-2-(2-(methylthio)-1-buten-1-yl)-, iodide (1:1), Benzoselenazolium, 3-ethyl-5-methoxy-2-(2-(methylthio)-1-butenyl)-, iodide, Benzoselenazolium, 3-ethyl-5-methoxy-2-(2-(methylthio)-1-butenyl)-,iodide
Technical Specifications
| Molecular Formula | C15H20INOSSe |
| Molecular Weight | 468.94754 g/mol |
| XLogP | 0.33 |
| Topological Polar Surface Area (TPSA) | 38.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 468.94754 Da |
| Heavy Atoms | 20 |
| Complexity | 323.0 |
| SMILES | CCC(=CC1=[N+](C2=C([Se]1)C=CC(=C2)OC)CC)SC.[I-] |
| InChIKey | LQFHUGPISHCWSH-UHFFFAOYSA-M |
Chemical Property Profile of RefChem:118558
Property Insights of RefChem:118558
The XLogP value of 0.33 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:118558. With a topological polar surface area (TPSA) of 38.4 Ų, RefChem:118558 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:118558 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
What is the CAS number of RefChem:118558?
The CAS number of RefChem:118558 is 63816-17-1.
What is the molecular formula of RefChem:118558?
The molecular formula of RefChem:118558 is C15H20INOSSe.
What is the molecular weight of RefChem:118558?
The molecular weight of RefChem:118558 is 468.94754 g/mol.
Where can I buy RefChem:118558?
You can request a quote for RefChem:118558 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:118558?
Yes, CoreyChem provides custom synthesis services for RefChem:118558 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.