4-Ethyldihydro-2,6-dimethyl-4H-1,3,5-dithiazine
TL;DR: 4-Ethyldihydro-2,6-dimethyl-4H-1,3,5-dithiazine (CAS 54717-13-4) is a chemical compound with molecular formula C7H15NS2 and molecular weight 177.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethyl-2,6-dimethyl-1,3,5-dithiazinane
Also Known As: Fema No. 4667, 4-ethyl-, 4-ethyl-2,6-dimethyl-1,3,5-dithiazinane, 4-Ethyldihydro-2,6-dimethyl-4H-1,3,5-dithiazine, 4-Ethyl-2,6-dimethyldihydro-1,3,5- dithiazine, 1,3,5-Dithiazine, perhydro, 4-ethyl-2,6-dimethyl, #2
| Molecular Formula | C7H15NS2 |
|---|---|
| Molecular Weight | 177.06 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 177.06459 |
| Heavy Atoms | 10 |
| Complexity | 108.0 |
Chemical Identifiers
| CAS Number | 54717-13-4 |
|---|---|
| SMILES | CCC1NC(SC(S1)C)C |
| InChIKey | ZORZRADCTZBZSE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Ethyldihydro-2,6-dimethyl-4H-1,3,5-dithiazine (CAS 54717-13-4), with molecular formula C7H15NS2 and molecular weight 177.06 g/mol. IUPAC: 4-ethyl-2,6-dimethyl-1,3,5-dithiazinane.
Chemical Property Profile of 4-Ethyldihydro-2,6-dimethyl-4H-1,3,5-dithiazine
Property Insights of 4-Ethyldihydro-2,6-dimethyl-4H-1,3,5-dithiazine
The XLogP value of 3.0 indicates that 4-Ethyldihydro-2,6-dimethyl-4H-1,3,5-dithiazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Ethyldihydro-2,6-dimethyl-4H-1,3,5-dithiazine. Following Lipinski's Rule of Five, 4-Ethyldihydro-2,6-dimethyl-4H-1,3,5-dithiazine has 1 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-Ethyldihydro-2,6-dimethyl-4H-1,3,5-dithiazine?
The CAS number of 4-Ethyldihydro-2,6-dimethyl-4H-1,3,5-dithiazine is 54717-13-4.
What is the molecular formula of 4-Ethyldihydro-2,6-dimethyl-4H-1,3,5-dithiazine?
The molecular formula of 4-Ethyldihydro-2,6-dimethyl-4H-1,3,5-dithiazine is C7H15NS2.
What is the molecular weight of 4-Ethyldihydro-2,6-dimethyl-4H-1,3,5-dithiazine?
The molecular weight of 4-Ethyldihydro-2,6-dimethyl-4H-1,3,5-dithiazine is 177.06 g/mol.
Where can I buy 4-Ethyldihydro-2,6-dimethyl-4H-1,3,5-dithiazine?
You can request a quote for 4-Ethyldihydro-2,6-dimethyl-4H-1,3,5-dithiazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Ethyldihydro-2,6-dimethyl-4H-1,3,5-dithiazine?
Yes, KEHONG BIO provides custom synthesis services for 4-Ethyldihydro-2,6-dimethyl-4H-1,3,5-dithiazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.