1-(2-(Phenylsulfonyl)ethyl)pyrrolidine
TL;DR: 1-(2-(Phenylsulfonyl)ethyl)pyrrolidine (CAS 649760-40-7) is a chemical compound with molecular formula C12H17NO2S and molecular weight 239.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(benzenesulfonyl)ethyl]pyrrolidine
Also Known As: 1-[2-(benzenesulfonyl)ethyl]pyrrolidine, SDCCGMLS-0066119.P001, 1-(2-(Phenylsulfonyl)ethyl)pyrrolidine, 1-[2-(phenylsulphonyl)ethyl]pyrrolidine, 1-[2-(phenylsulfonyl)ethyl]pyrrolidine
| Molecular Formula | C12H17NO2S |
|---|---|
| Molecular Weight | 239.10 g/mol |
| LogP | 1.5561 |
| Topological Polar Surface Area | 37.38 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 239.098 |
| Heavy Atoms | 16 |
| Complexity | 421.5918 |
Chemical Identifiers
| CAS Number | 649760-40-7 |
|---|---|
| SMILES | C1CCN(C1)CCS(=O)(=O)C2=CC=CC=C2 |
Product Overview
1-(2-(Phenylsulfonyl)ethyl)pyrrolidine (CAS 649760-40-7), with molecular formula C12H17NO2S and molecular weight 239.10 g/mol. IUPAC: 1-[2-(benzenesulfonyl)ethyl]pyrrolidine.
Chemical Property Profile of 1-(2-(Phenylsulfonyl)ethyl)pyrrolidine
Property Insights of 1-(2-(Phenylsulfonyl)ethyl)pyrrolidine
The XLogP value of 1.5561 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-(Phenylsulfonyl)ethyl)pyrrolidine. With a topological polar surface area (TPSA) of 37.38 Ų, 1-(2-(Phenylsulfonyl)ethyl)pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-(Phenylsulfonyl)ethyl)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
Frequently Asked Questions
What is the CAS number of 1-(2-(Phenylsulfonyl)ethyl)pyrrolidine?
The CAS number of 1-(2-(Phenylsulfonyl)ethyl)pyrrolidine is 649760-40-7.
What is the molecular formula of 1-(2-(Phenylsulfonyl)ethyl)pyrrolidine?
The molecular formula of 1-(2-(Phenylsulfonyl)ethyl)pyrrolidine is C12H17NO2S.
What is the molecular weight of 1-(2-(Phenylsulfonyl)ethyl)pyrrolidine?
The molecular weight of 1-(2-(Phenylsulfonyl)ethyl)pyrrolidine is 239.10 g/mol.
Where can I buy 1-(2-(Phenylsulfonyl)ethyl)pyrrolidine?
You can request a quote for 1-(2-(Phenylsulfonyl)ethyl)pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-(Phenylsulfonyl)ethyl)pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-(Phenylsulfonyl)ethyl)pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.