1-Tosylimino-1,3-dithiane-1,3,3-trioxide
TL;DR: 1-Tosylimino-1,3-dithiane-1,3,3-trioxide (CAS 58485-00-0) is a chemical compound with molecular formula C11H15NO5S3 and molecular weight 337.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-(1,3,3-trioxo-1,3-dithian-1-ylidene)benzenesulfonamide
Also Known As: Maybridge1_004749, 1-tosylimino-1,3-dithiane-1,3,3-trioxide, 4-methyl-N-(1,3,3-trioxo-1,3-dithian-1-ylidene)benzenesulfonamide
| Molecular Formula | C11H15NO5S3 |
|---|---|
| Molecular Weight | 337.01 g/mol |
| LogP | 0.92772 |
| Topological Polar Surface Area | 97.71 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 337.01123 |
| Heavy Atoms | 20 |
| Complexity | 828.54974 |
Chemical Identifiers
| CAS Number | 58485-00-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N=S2(=O)CCCS(=O)(=O)C2 |
Product Overview
1-Tosylimino-1,3-dithiane-1,3,3-trioxide (CAS 58485-00-0), with molecular formula C11H15NO5S3 and molecular weight 337.01 g/mol. IUPAC: 4-methyl-N-(1,3,3-trioxo-1,3-dithian-1-ylidene)benzenesulfonamide.
Chemical Property Profile of 1-Tosylimino-1,3-dithiane-1,3,3-trioxide
Property Insights of 1-Tosylimino-1,3-dithiane-1,3,3-trioxide
The XLogP value of 0.92772 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Tosylimino-1,3-dithiane-1,3,3-trioxide. The TPSA of 97.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Tosylimino-1,3-dithiane-1,3,3-trioxide. Following Lipinski's Rule of Five, 1-Tosylimino-1,3-dithiane-1,3,3-trioxide has 0 hydrogen bond donor(s) and 5 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-Tosylimino-1,3-dithiane-1,3,3-trioxide?
The CAS number of 1-Tosylimino-1,3-dithiane-1,3,3-trioxide is 58485-00-0.
What is the molecular formula of 1-Tosylimino-1,3-dithiane-1,3,3-trioxide?
The molecular formula of 1-Tosylimino-1,3-dithiane-1,3,3-trioxide is C11H15NO5S3.
What is the molecular weight of 1-Tosylimino-1,3-dithiane-1,3,3-trioxide?
The molecular weight of 1-Tosylimino-1,3-dithiane-1,3,3-trioxide is 337.01 g/mol.
Where can I buy 1-Tosylimino-1,3-dithiane-1,3,3-trioxide?
You can request a quote for 1-Tosylimino-1,3-dithiane-1,3,3-trioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Tosylimino-1,3-dithiane-1,3,3-trioxide?
Yes, KEHONG BIO provides custom synthesis services for 1-Tosylimino-1,3-dithiane-1,3,3-trioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.