(2-(tert-Butyl)-5-(methylthio)oxazol-4-yl)triphenylphosphonium iodide
TL;DR: (2-(tert-Butyl)-5-(methylthio)oxazol-4-yl)triphenylphosphonium iodide (CAS 122418-68-2) is a chemical compound with molecular formula C26H27INOPS and molecular weight 559.0596 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-tert-butyl-5-methylsulfanyl-1,3-oxazol-4-yl)-triphenylphosphanium iodide
Also Known As: (2-(tert-Butyl)-5-(methylthio)oxazol-4-yl)triphenylphosphonium iodide, (2-tert-butyl-5-methylsulfanyl-1,3-oxazol-4-yl)-triphenylphosphanium;iodide, (2-(tert-Butyl)-5-(methylthio)oxazol-4-yl)triphenylphosphoniumiodide, (2-tert-butyl-5-methylsulfanyl-1,3-oxazol-4-yl)-triphenylphosphanium iodide, (2-TERT-BUTYL-5-METHYLSULFANYL-OXAZOL-4-YL)TRIPHENYLPHOSPHONIUM IODIDE
Technical Specifications
| Molecular Formula | C26H27INOPS |
| Molecular Weight | 559.0596 g/mol |
| XLogP | 2.3174 |
| Topological Polar Surface Area (TPSA) | 51.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 559.0596 Da |
| Heavy Atoms | 31 |
| Complexity | 486.0 |
| SMILES | CC(C)(C)C1=NC(=C(O1)SC)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[I-] |
| InChIKey | QVRIQUXEXJBADI-UHFFFAOYSA-M |
Chemical Property Profile of (2-(tert-Butyl)-5-(methylthio)oxazol-4-yl)triphenylphosphonium iodide
Property Insights of (2-(tert-Butyl)-5-(methylthio)oxazol-4-yl)triphenylphosphonium iodide
The XLogP value of 2.3174 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-(tert-Butyl)-5-(methylthio)oxazol-4-yl)triphenylphosphonium iodide. With a topological polar surface area (TPSA) of 51.3 Ų, (2-(tert-Butyl)-5-(methylthio)oxazol-4-yl)triphenylphosphonium iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-(tert-Butyl)-5-(methylthio)oxazol-4-yl)triphenylphosphonium iodide has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of (2-(tert-Butyl)-5-(methylthio)oxazol-4-yl)triphenylphosphonium iodide?
The CAS number of (2-(tert-Butyl)-5-(methylthio)oxazol-4-yl)triphenylphosphonium iodide is 122418-68-2.
What is the molecular formula of (2-(tert-Butyl)-5-(methylthio)oxazol-4-yl)triphenylphosphonium iodide?
The molecular formula of (2-(tert-Butyl)-5-(methylthio)oxazol-4-yl)triphenylphosphonium iodide is C26H27INOPS.
What is the molecular weight of (2-(tert-Butyl)-5-(methylthio)oxazol-4-yl)triphenylphosphonium iodide?
The molecular weight of (2-(tert-Butyl)-5-(methylthio)oxazol-4-yl)triphenylphosphonium iodide is 559.0596 g/mol.
Where can I buy (2-(tert-Butyl)-5-(methylthio)oxazol-4-yl)triphenylphosphonium iodide?
You can request a quote for (2-(tert-Butyl)-5-(methylthio)oxazol-4-yl)triphenylphosphonium iodide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2-(tert-Butyl)-5-(methylthio)oxazol-4-yl)triphenylphosphonium iodide?
Yes, CoreyChem provides custom synthesis services for (2-(tert-Butyl)-5-(methylthio)oxazol-4-yl)triphenylphosphonium iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.