4,4,6-Trimethyl-3,4-dihydro-2H-1,3-thiazine-2-thione
TL;DR: 4,4,6-Trimethyl-3,4-dihydro-2H-1,3-thiazine-2-thione (CAS 58417-83-7) 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.
4,4,6-trimethyl-3H-1,3-thiazine-2-thione
Also Known As: 4,4,6-trimethyl-4H-1,3-thiazine-2-thiol, 4,4,6-trimethyl-[1,3]thiazine-2-thiol, 4,4,6-trimethyl-3H-1,3-thiazine-2-thione, 4,4,6-Trimethyl-3,4-dihydro-2H-1,3-thiazine-2-thione, 4,4,6-Trimethyl-3,4-dihydro-2H-1,3-thiazin-2-thione
| 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 | 58417-83-7 |
|---|---|
| SMILES | CC1=CC(NC(=S)S1)(C)C |
Product Overview
4,4,6-Trimethyl-3,4-dihydro-2H-1,3-thiazine-2-thione (CAS 58417-83-7), with molecular formula C7H11NS2 and molecular weight 173.03 g/mol. IUPAC: 4,4,6-trimethyl-3H-1,3-thiazine-2-thione.
Chemical Property Profile of 4,4,6-Trimethyl-3,4-dihydro-2H-1,3-thiazine-2-thione
Property Insights of 4,4,6-Trimethyl-3,4-dihydro-2H-1,3-thiazine-2-thione
The XLogP value of 2.2901 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4,6-Trimethyl-3,4-dihydro-2H-1,3-thiazine-2-thione. With a topological polar surface area (TPSA) of 12.03 Ų, 4,4,6-Trimethyl-3,4-dihydro-2H-1,3-thiazine-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4,6-Trimethyl-3,4-dihydro-2H-1,3-thiazine-2-thione 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 4,4,6-Trimethyl-3,4-dihydro-2H-1,3-thiazine-2-thione?
The CAS number of 4,4,6-Trimethyl-3,4-dihydro-2H-1,3-thiazine-2-thione is 58417-83-7.
What is the molecular formula of 4,4,6-Trimethyl-3,4-dihydro-2H-1,3-thiazine-2-thione?
The molecular formula of 4,4,6-Trimethyl-3,4-dihydro-2H-1,3-thiazine-2-thione is C7H11NS2.
What is the molecular weight of 4,4,6-Trimethyl-3,4-dihydro-2H-1,3-thiazine-2-thione?
The molecular weight of 4,4,6-Trimethyl-3,4-dihydro-2H-1,3-thiazine-2-thione is 173.03 g/mol.
Where can I buy 4,4,6-Trimethyl-3,4-dihydro-2H-1,3-thiazine-2-thione?
You can request a quote for 4,4,6-Trimethyl-3,4-dihydro-2H-1,3-thiazine-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4,6-Trimethyl-3,4-dihydro-2H-1,3-thiazine-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 4,4,6-Trimethyl-3,4-dihydro-2H-1,3-thiazine-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.