6-Benzyl-2-methylthiazinane 1,1-dioxide
TL;DR: 6-Benzyl-2-methylthiazinane 1,1-dioxide (CAS 54531-82-7) 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.
6-benzyl-2-methylthiazinane 1,1-dioxide
Also Known As: 6-benzyl-2-methylthiazinane 1,1-dioxide, 6-benzyl-2-methyl-[1,2]thiazinane 1,1-dioxide, 6-Benzyl-2-methyl-1lambda~6~,2-thiazinane-1,1-dione
| Molecular Formula | C12H17NO2S |
|---|---|
| Molecular Weight | 239.10 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 239.098 |
| Heavy Atoms | 16 |
| Complexity | 314.0 |
Chemical Identifiers
| CAS Number | 54531-82-7 |
|---|---|
| SMILES | CN1CCCC(S1(=O)=O)CC2=CC=CC=C2 |
| InChIKey | LJVSUFPCQJHVOQ-UHFFFAOYSA-N |
Product Overview
6-Benzyl-2-methylthiazinane 1,1-dioxide (CAS 54531-82-7), with molecular formula C12H17NO2S and molecular weight 239.10 g/mol. IUPAC: 6-benzyl-2-methylthiazinane 1,1-dioxide.
Chemical Property Profile of 6-Benzyl-2-methylthiazinane 1,1-dioxide
Property Insights of 6-Benzyl-2-methylthiazinane 1,1-dioxide
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Benzyl-2-methylthiazinane 1,1-dioxide. With a topological polar surface area (TPSA) of 45.8 Ų, 6-Benzyl-2-methylthiazinane 1,1-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Benzyl-2-methylthiazinane 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 6-Benzyl-2-methylthiazinane 1,1-dioxide?
The CAS number of 6-Benzyl-2-methylthiazinane 1,1-dioxide is 54531-82-7.
What is the molecular formula of 6-Benzyl-2-methylthiazinane 1,1-dioxide?
The molecular formula of 6-Benzyl-2-methylthiazinane 1,1-dioxide is C12H17NO2S.
What is the molecular weight of 6-Benzyl-2-methylthiazinane 1,1-dioxide?
The molecular weight of 6-Benzyl-2-methylthiazinane 1,1-dioxide is 239.10 g/mol.
Where can I buy 6-Benzyl-2-methylthiazinane 1,1-dioxide?
You can request a quote for 6-Benzyl-2-methylthiazinane 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 6-Benzyl-2-methylthiazinane 1,1-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 6-Benzyl-2-methylthiazinane 1,1-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.