4,4-Bis(methylsulfanyl)morpholin-4-ium iodide
TL;DR: 4,4-Bis(methylsulfanyl)morpholin-4-ium iodide (CAS 64039-05-0) is a chemical compound with molecular formula C6H14INOS2 and molecular weight 306.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-bis(methylsulfanyl)morpholin-4-ium iodide
Also Known As: N,N-Dimethylthiomorpholinium iodide, USAF A-5200, Thiomorpholinium, 4,4-dimethyl-, iodide, 4,4-bis(methylsulfanyl)morpholin-4-ium iodide, RefChem:1069321
| Molecular Formula | C6H14INOS2 |
|---|---|
| Molecular Weight | 306.96 g/mol |
| LogP | -1.61 |
| Topological Polar Surface Area | 59.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 306.95615 |
| Heavy Atoms | 11 |
| Complexity | 97.0 |
Chemical Identifiers
| CAS Number | 64039-05-0 |
|---|---|
| SMILES | CS[N+]1(CCOCC1)SC.[I-] |
| InChIKey | RDALEAFBVMSZOT-UHFFFAOYSA-M |
Product Overview
4,4-Bis(methylsulfanyl)morpholin-4-ium iodide (CAS 64039-05-0), with molecular formula C6H14INOS2 and molecular weight 306.96 g/mol. IUPAC: 4,4-bis(methylsulfanyl)morpholin-4-ium iodide.
Chemical Property Profile of 4,4-Bis(methylsulfanyl)morpholin-4-ium iodide
Property Insights of 4,4-Bis(methylsulfanyl)morpholin-4-ium iodide
The XLogP value of -1.61 indicates that 4,4-Bis(methylsulfanyl)morpholin-4-ium iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 59.8 Ų, 4,4-Bis(methylsulfanyl)morpholin-4-ium iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4-Bis(methylsulfanyl)morpholin-4-ium iodide has 0 hydrogen bond donor(s) and 4 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-Bis(methylsulfanyl)morpholin-4-ium iodide?
The CAS number of 4,4-Bis(methylsulfanyl)morpholin-4-ium iodide is 64039-05-0.
What is the molecular formula of 4,4-Bis(methylsulfanyl)morpholin-4-ium iodide?
The molecular formula of 4,4-Bis(methylsulfanyl)morpholin-4-ium iodide is C6H14INOS2.
What is the molecular weight of 4,4-Bis(methylsulfanyl)morpholin-4-ium iodide?
The molecular weight of 4,4-Bis(methylsulfanyl)morpholin-4-ium iodide is 306.96 g/mol.
Where can I buy 4,4-Bis(methylsulfanyl)morpholin-4-ium iodide?
You can request a quote for 4,4-Bis(methylsulfanyl)morpholin-4-ium iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4-Bis(methylsulfanyl)morpholin-4-ium iodide?
Yes, KEHONG BIO provides custom synthesis services for 4,4-Bis(methylsulfanyl)morpholin-4-ium iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.