2-Methyl-1-(4-methylphenyl)sulfonylpyrrole
TL;DR: 2-Methyl-1-(4-methylphenyl)sulfonylpyrrole (CAS 17900-53-7) is a chemical compound with molecular formula C12H13NO2S and molecular weight 235.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-1-(4-methylphenyl)sulfonylpyrrole
Also Known As: 1-Tosyl-2-methyl-1H-pyrrole, 2-methyl-1-(4-methylphenyl)sulfonylpyrrole, BAS 00287893, 2-Methyl-1-(toluene-4-sulfonyl)-1H-pyrrole, J2.119.229E
| Molecular Formula | C12H13NO2S |
|---|---|
| Molecular Weight | 235.07 g/mol |
| LogP | 2.34194 |
| Topological Polar Surface Area | 39.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.0667 |
| Heavy Atoms | 16 |
| Complexity | 594.2039 |
Chemical Identifiers
| CAS Number | 17900-53-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2C=CC=C2C |
Product Overview
2-Methyl-1-(4-methylphenyl)sulfonylpyrrole (CAS 17900-53-7), with molecular formula C12H13NO2S and molecular weight 235.07 g/mol. IUPAC: 2-methyl-1-(4-methylphenyl)sulfonylpyrrole.
Chemical Property Profile of 2-Methyl-1-(4-methylphenyl)sulfonylpyrrole
Property Insights of 2-Methyl-1-(4-methylphenyl)sulfonylpyrrole
The XLogP value of 2.34194 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-1-(4-methylphenyl)sulfonylpyrrole. With a topological polar surface area (TPSA) of 39.07 Ų, 2-Methyl-1-(4-methylphenyl)sulfonylpyrrole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-1-(4-methylphenyl)sulfonylpyrrole 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 2-Methyl-1-(4-methylphenyl)sulfonylpyrrole?
The CAS number of 2-Methyl-1-(4-methylphenyl)sulfonylpyrrole is 17900-53-7.
What is the molecular formula of 2-Methyl-1-(4-methylphenyl)sulfonylpyrrole?
The molecular formula of 2-Methyl-1-(4-methylphenyl)sulfonylpyrrole is C12H13NO2S.
What is the molecular weight of 2-Methyl-1-(4-methylphenyl)sulfonylpyrrole?
The molecular weight of 2-Methyl-1-(4-methylphenyl)sulfonylpyrrole is 235.07 g/mol.
Where can I buy 2-Methyl-1-(4-methylphenyl)sulfonylpyrrole?
You can request a quote for 2-Methyl-1-(4-methylphenyl)sulfonylpyrrole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-1-(4-methylphenyl)sulfonylpyrrole?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-1-(4-methylphenyl)sulfonylpyrrole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.