3-Thiomorpholinone, 5-ethyl-2-methyl-
TL;DR: 3-Thiomorpholinone, 5-ethyl-2-methyl- (CAS 69226-17-1) is a chemical compound with molecular formula C7H13NOS and molecular weight 159.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-2-methylmorpholine-3-thione
Also Known As: 5-Ethyl-2-methyl-3-thiomorpholinone, 3-Thiomorpholinone, 5-ethyl-2-methyl-, 2,4-dihydroxy-3-methylacetophenone, 5-ethyl-2-methylmorpholine-3-thione, 4-27-00-02571 (Beilstein Handbook Reference)
| Molecular Formula | C7H13NOS |
|---|---|
| Molecular Weight | 159.07 g/mol |
| LogP | 1.1007 |
| Topological Polar Surface Area | 21.26 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 159.0718 |
| Heavy Atoms | 10 |
| Complexity | 137.5678 |
Chemical Identifiers
| CAS Number | 69226-17-1 |
|---|---|
| SMILES | CCC1COC(C(=S)N1)C |
Product Overview
3-Thiomorpholinone, 5-ethyl-2-methyl- (CAS 69226-17-1), with molecular formula C7H13NOS and molecular weight 159.07 g/mol. IUPAC: 5-ethyl-2-methylmorpholine-3-thione.
Chemical Property Profile of 3-Thiomorpholinone, 5-ethyl-2-methyl-
Property Insights of 3-Thiomorpholinone, 5-ethyl-2-methyl-
The XLogP value of 1.1007 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Thiomorpholinone, 5-ethyl-2-methyl-. With a topological polar surface area (TPSA) of 21.26 Ų, 3-Thiomorpholinone, 5-ethyl-2-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Thiomorpholinone, 5-ethyl-2-methyl- 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 3-Thiomorpholinone, 5-ethyl-2-methyl-?
The CAS number of 3-Thiomorpholinone, 5-ethyl-2-methyl- is 69226-17-1.
What is the molecular formula of 3-Thiomorpholinone, 5-ethyl-2-methyl-?
The molecular formula of 3-Thiomorpholinone, 5-ethyl-2-methyl- is C7H13NOS.
What is the molecular weight of 3-Thiomorpholinone, 5-ethyl-2-methyl-?
The molecular weight of 3-Thiomorpholinone, 5-ethyl-2-methyl- is 159.07 g/mol.
Where can I buy 3-Thiomorpholinone, 5-ethyl-2-methyl-?
You can request a quote for 3-Thiomorpholinone, 5-ethyl-2-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Thiomorpholinone, 5-ethyl-2-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 3-Thiomorpholinone, 5-ethyl-2-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.