1-Tosylpyrrole
TL;DR: 1-Tosylpyrrole (CAS 17639-64-4) is a chemical compound with molecular formula C11H11NO2S and molecular weight 221.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-methylphenyl)sulfonylpyrrole
Also Known As: 1-Tosylpyrrole, 1-tosyl-1H-pyrrole, N-Tosylpyrrole, 1-(p-Toluenesulfonyl)pyrrole, 1-Tosyl Pyrrole
| Molecular Formula | C11H11NO2S |
|---|---|
| Molecular Weight | 221.05 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 47.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.05106 |
| Heavy Atoms | 15 |
| Complexity | 293.0 |
Chemical Identifiers
| CAS Number | 17639-64-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2C=CC=C2 |
| InChIKey | OXWIEWFMRVJGNY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Tosylpyrrole (CAS 17639-64-4), with molecular formula C11H11NO2S and molecular weight 221.05 g/mol. IUPAC: 1-(4-methylphenyl)sulfonylpyrrole.
Chemical Property Profile of 1-Tosylpyrrole
Property Insights of 1-Tosylpyrrole
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Tosylpyrrole. With a topological polar surface area (TPSA) of 47.5 Ų, 1-Tosylpyrrole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Tosylpyrrole has 0 hydrogen bond donor(s) and 2 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-Tosylpyrrole?
The CAS number of 1-Tosylpyrrole is 17639-64-4.
What is the molecular formula of 1-Tosylpyrrole?
The molecular formula of 1-Tosylpyrrole is C11H11NO2S.
What is the molecular weight of 1-Tosylpyrrole?
The molecular weight of 1-Tosylpyrrole is 221.05 g/mol.
Where can I buy 1-Tosylpyrrole?
You can request a quote for 1-Tosylpyrrole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Tosylpyrrole?
Yes, KEHONG BIO provides custom synthesis services for 1-Tosylpyrrole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.