2-Mercapto-4,6,6-trimethylthiazine
TL;DR: 2-Mercapto-4,6,6-trimethylthiazine (CAS 17374-21-9) is a chemical compound with molecular formula C7H11NS2 and molecular weight 173.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6,6-trimethyl-3H-1,3-thiazine-2-thione
Also Known As: 2-Mercapto-4,6,6-trimethylthiazine, 2-Mercapto-4,6-trimethylthiazine, 6H-1, 4,6,6-trimethyl-, 4,6,6-trimethyl-3H-1,3-thiazine-2-thione, 4,6,6-trimethyl-6h-1,3-thiazine-2-thiol
| Molecular Formula | C7H11NS2 |
|---|---|
| Molecular Weight | 173.03 g/mol |
| LogP | 2.2901 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 173.0333 |
| Heavy Atoms | 10 |
| Complexity | 193.78279 |
Chemical Identifiers
| CAS Number | 17374-21-9 |
|---|---|
| SMILES | CC1=CC(SC(=S)N1)(C)C |
Product Overview
2-Mercapto-4,6,6-trimethylthiazine (CAS 17374-21-9), with molecular formula C7H11NS2 and molecular weight 173.03 g/mol. IUPAC: 4,6,6-trimethyl-3H-1,3-thiazine-2-thione.
Chemical Property Profile of 2-Mercapto-4,6,6-trimethylthiazine
Property Insights of 2-Mercapto-4,6,6-trimethylthiazine
The XLogP value of 2.2901 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Mercapto-4,6,6-trimethylthiazine. With a topological polar surface area (TPSA) of 12.03 Ų, 2-Mercapto-4,6,6-trimethylthiazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Mercapto-4,6,6-trimethylthiazine has 1 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-Mercapto-4,6,6-trimethylthiazine?
The CAS number of 2-Mercapto-4,6,6-trimethylthiazine is 17374-21-9.
What is the molecular formula of 2-Mercapto-4,6,6-trimethylthiazine?
The molecular formula of 2-Mercapto-4,6,6-trimethylthiazine is C7H11NS2.
What is the molecular weight of 2-Mercapto-4,6,6-trimethylthiazine?
The molecular weight of 2-Mercapto-4,6,6-trimethylthiazine is 173.03 g/mol.
Where can I buy 2-Mercapto-4,6,6-trimethylthiazine?
You can request a quote for 2-Mercapto-4,6,6-trimethylthiazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Mercapto-4,6,6-trimethylthiazine?
Yes, KEHONG BIO provides custom synthesis services for 2-Mercapto-4,6,6-trimethylthiazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.