![3-[(4-Methylphenyl)sulfonyl]-3-azatricyclo[3.2.1.0~2,4~]octane structure](/static/products/1322/13225-54-2.webp)
3-[(4-Methylphenyl)sulfonyl]-3-azatricyclo[3.2.1.0~2,4~]octane
TL;DR: 3-[(4-Methylphenyl)sulfonyl]-3-azatricyclo[3.2.1.0~2,4~]octane (CAS 13225-54-2) is a chemical compound with molecular formula C14H17NO2S and molecular weight 263.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methylphenyl)sulfonyl-3-azatricyclo[3.2.1.02,4]octane
Also Known As: 3-[(4-methylphenyl)sulfonyl]-3-azatricyclo[3.2.1.0~2,4~]octane, 3-Tosyl-3-azatricyclo[3.2.1.02,4]octane, AE-842/31986031, 7-Tosyl-2,5-methano-7-azabicyclo[4.1.0]heptane, 3-(p-Tolylsulfonyl)-3-azatricyclo[3.2.1.02,4]octane
| Molecular Formula | C14H17NO2S |
|---|---|
| Molecular Weight | 263.10 g/mol |
| LogP | 2.16642 |
| Topological Polar Surface Area | 37.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 263.098 |
| Heavy Atoms | 18 |
| Complexity | 576.7249 |
Chemical Identifiers
| CAS Number | 13225-54-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2C3C2C4CCC3C4 |
Product Overview
3-[(4-Methylphenyl)sulfonyl]-3-azatricyclo[3.2.1.0~2,4~]octane (CAS 13225-54-2), with molecular formula C14H17NO2S and molecular weight 263.10 g/mol. IUPAC: 3-(4-methylphenyl)sulfonyl-3-azatricyclo[3.2.1.02,4]octane.
Chemical Property Profile of 3-[(4-Methylphenyl)sulfonyl]-3-azatricyclo[3.2.1.0~2,4~]octane
Property Insights of 3-[(4-Methylphenyl)sulfonyl]-3-azatricyclo[3.2.1.0~2,4~]octane
The XLogP value of 2.16642 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(4-Methylphenyl)sulfonyl]-3-azatricyclo[3.2.1.0~2,4~]octane. With a topological polar surface area (TPSA) of 37.15 Ų, 3-[(4-Methylphenyl)sulfonyl]-3-azatricyclo[3.2.1.0~2,4~]octane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(4-Methylphenyl)sulfonyl]-3-azatricyclo[3.2.1.0~2,4~]octane 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 3-[(4-Methylphenyl)sulfonyl]-3-azatricyclo[3.2.1.0~2,4~]octane?
The CAS number of 3-[(4-Methylphenyl)sulfonyl]-3-azatricyclo[3.2.1.0~2,4~]octane is 13225-54-2.
What is the molecular formula of 3-[(4-Methylphenyl)sulfonyl]-3-azatricyclo[3.2.1.0~2,4~]octane?
The molecular formula of 3-[(4-Methylphenyl)sulfonyl]-3-azatricyclo[3.2.1.0~2,4~]octane is C14H17NO2S.
What is the molecular weight of 3-[(4-Methylphenyl)sulfonyl]-3-azatricyclo[3.2.1.0~2,4~]octane?
The molecular weight of 3-[(4-Methylphenyl)sulfonyl]-3-azatricyclo[3.2.1.0~2,4~]octane is 263.10 g/mol.
Where can I buy 3-[(4-Methylphenyl)sulfonyl]-3-azatricyclo[3.2.1.0~2,4~]octane?
You can request a quote for 3-[(4-Methylphenyl)sulfonyl]-3-azatricyclo[3.2.1.0~2,4~]octane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(4-Methylphenyl)sulfonyl]-3-azatricyclo[3.2.1.0~2,4~]octane?
Yes, KEHONG BIO provides custom synthesis services for 3-[(4-Methylphenyl)sulfonyl]-3-azatricyclo[3.2.1.0~2,4~]octane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.