1-((5-Bromo-2-methylphenyl)sulfonyl)pyrrolidine
TL;DR: 1-((5-Bromo-2-methylphenyl)sulfonyl)pyrrolidine (CAS 1178386-07-6) is a chemical compound with molecular formula C11H14BrNO2S and molecular weight 302.99286 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(5-bromo-2-methylphenyl)sulfonylpyrrolidine
Also Known As: 1-((5-bromo-2-methylphenyl)sulfonyl)pyrrolidine, 1-(5-bromo-2-methylphenyl)sulfonylpyrrolidine, 1-(5-bromo-2-methyl-phenyl)sulfonylpyrrolidine, 1-(5-Bromo-2-methyl-benzenesulfonyl)-pyrrolidine, A1-33170
Technical Specifications
| Molecular Formula | C11H14BrNO2S |
| Molecular Weight | 302.99286 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 302.99286 Da |
| Heavy Atoms | 16 |
| Complexity | 332.0 |
| SMILES | CC1=C(C=C(C=C1)Br)S(=O)(=O)N2CCCC2 |
| InChIKey | VJQARCQKLYUQGF-UHFFFAOYSA-N |
Chemical Property Profile of 1-((5-Bromo-2-methylphenyl)sulfonyl)pyrrolidine
Property Insights of 1-((5-Bromo-2-methylphenyl)sulfonyl)pyrrolidine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-((5-Bromo-2-methylphenyl)sulfonyl)pyrrolidine. With a topological polar surface area (TPSA) of 45.8 Ų, 1-((5-Bromo-2-methylphenyl)sulfonyl)pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-((5-Bromo-2-methylphenyl)sulfonyl)pyrrolidine 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 1-((5-Bromo-2-methylphenyl)sulfonyl)pyrrolidine?
The CAS number of 1-((5-Bromo-2-methylphenyl)sulfonyl)pyrrolidine is 1178386-07-6.
What is the molecular formula of 1-((5-Bromo-2-methylphenyl)sulfonyl)pyrrolidine?
The molecular formula of 1-((5-Bromo-2-methylphenyl)sulfonyl)pyrrolidine is C11H14BrNO2S.
What is the molecular weight of 1-((5-Bromo-2-methylphenyl)sulfonyl)pyrrolidine?
The molecular weight of 1-((5-Bromo-2-methylphenyl)sulfonyl)pyrrolidine is 302.99286 g/mol.
Where can I buy 1-((5-Bromo-2-methylphenyl)sulfonyl)pyrrolidine?
You can request a quote for 1-((5-Bromo-2-methylphenyl)sulfonyl)pyrrolidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-((5-Bromo-2-methylphenyl)sulfonyl)pyrrolidine?
Yes, CoreyChem provides custom synthesis services for 1-((5-Bromo-2-methylphenyl)sulfonyl)pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.