4-Benzylthiomorpholine 1,1-Dioxide
TL;DR: 4-Benzylthiomorpholine 1,1-Dioxide (CAS 26475-66-1) is a chemical compound with molecular formula C11H15NO2S and molecular weight 225.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-benzyl-1,4-thiazinane 1,1-dioxide
Also Known As: 4-Benzylthiomorpholine 1,1-Dioxide, 4-benzyl-1,4-thiazinane 1,1-dioxide, Maybridge1_003205, 4-Benzylthiomorpholine-1,1-dioxide, 4-Benzyl-thiazan-1,1-dioxid
| Molecular Formula | C11H15NO2S |
|---|---|
| Molecular Weight | 225.08 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.08235 |
| Heavy Atoms | 15 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 26475-66-1 |
|---|---|
| SMILES | C1CS(=O)(=O)CCN1CC2=CC=CC=C2 |
| InChIKey | KFAMTQFKYUXQKV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Benzylthiomorpholine 1,1-Dioxide (CAS 26475-66-1), with molecular formula C11H15NO2S and molecular weight 225.08 g/mol. IUPAC: 4-benzyl-1,4-thiazinane 1,1-dioxide.
Chemical Property Profile of 4-Benzylthiomorpholine 1,1-Dioxide
Property Insights of 4-Benzylthiomorpholine 1,1-Dioxide
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Benzylthiomorpholine 1,1-Dioxide. With a topological polar surface area (TPSA) of 45.8 Ų, 4-Benzylthiomorpholine 1,1-Dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Benzylthiomorpholine 1,1-Dioxide 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 4-Benzylthiomorpholine 1,1-Dioxide?
The CAS number of 4-Benzylthiomorpholine 1,1-Dioxide is 26475-66-1.
What is the molecular formula of 4-Benzylthiomorpholine 1,1-Dioxide?
The molecular formula of 4-Benzylthiomorpholine 1,1-Dioxide is C11H15NO2S.
What is the molecular weight of 4-Benzylthiomorpholine 1,1-Dioxide?
The molecular weight of 4-Benzylthiomorpholine 1,1-Dioxide is 225.08 g/mol.
Where can I buy 4-Benzylthiomorpholine 1,1-Dioxide?
You can request a quote for 4-Benzylthiomorpholine 1,1-Dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Benzylthiomorpholine 1,1-Dioxide?
Yes, KEHONG BIO provides custom synthesis services for 4-Benzylthiomorpholine 1,1-Dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.