2-(2-(Methylthio)phenyl)pyrrolidine
TL;DR: 2-(2-(Methylthio)phenyl)pyrrolidine (CAS 1213556-30-9) is a chemical compound with molecular formula C11H15NS and molecular weight 193.09251 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-methylsulfanylphenyl)pyrrolidine
Also Known As: 2-(2-(Methylthio)phenyl)pyrrolidine, 2-[2-(methylsulfanyl)phenyl]pyrrolidine, 2-(2-methylsulfanylphenyl)pyrrolidine, 2-(2-Methylsulfanyl-phenyl)-pyrrolidine, 1430AJ
Technical Specifications
| Molecular Formula | C11H15NS |
| Molecular Weight | 193.09251 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 193.09251 Da |
| Heavy Atoms | 13 |
| Complexity | 160.0 |
| SMILES | CSC1=CC=CC=C1C2CCCN2 |
| InChIKey | XLTYHQGKUJLXRU-UHFFFAOYSA-N |
Chemical Property Profile of 2-(2-(Methylthio)phenyl)pyrrolidine
Property Insights of 2-(2-(Methylthio)phenyl)pyrrolidine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-(Methylthio)phenyl)pyrrolidine. With a topological polar surface area (TPSA) of 37.3 Ų, 2-(2-(Methylthio)phenyl)pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-(Methylthio)phenyl)pyrrolidine has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(2-(Methylthio)phenyl)pyrrolidine?
The CAS number of 2-(2-(Methylthio)phenyl)pyrrolidine is 1213556-30-9.
What is the molecular formula of 2-(2-(Methylthio)phenyl)pyrrolidine?
The molecular formula of 2-(2-(Methylthio)phenyl)pyrrolidine is C11H15NS.
What is the molecular weight of 2-(2-(Methylthio)phenyl)pyrrolidine?
The molecular weight of 2-(2-(Methylthio)phenyl)pyrrolidine is 193.09251 g/mol.
Where can I buy 2-(2-(Methylthio)phenyl)pyrrolidine?
You can request a quote for 2-(2-(Methylthio)phenyl)pyrrolidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(2-(Methylthio)phenyl)pyrrolidine?
Yes, CoreyChem provides custom synthesis services for 2-(2-(Methylthio)phenyl)pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.