3-Ethoxy-4-(4-thiomorpholinyl)-3-cyclobutene-1,2-dione
TL;DR: 3-Ethoxy-4-(4-thiomorpholinyl)-3-cyclobutene-1,2-dione (CAS 282093-50-9) is a chemical compound with molecular formula C10H13NO3S and molecular weight 227.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethoxy-4-thiomorpholin-4-ylcyclobut-3-ene-1,2-dione
Also Known As: 3-Ethoxy-4-(4-thiomorpholinyl)-3-cyclobutene-1,2-dione, BRD-K98276783-001-01-5, 3-ethoxy-4-thiomorpholin-4-ylcyclobut-3-ene-1,2-dione, 3-Ethoxy-4-(thiomorpholin-4-yl)cyclobut-3-ene-1,2-dione
| Molecular Formula | C10H13NO3S |
|---|---|
| Molecular Weight | 227.06 g/mol |
| LogP | 0.2345 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.06161 |
| Heavy Atoms | 15 |
| Complexity | 416.22095 |
Chemical Identifiers
| CAS Number | 282093-50-9 |
|---|---|
| SMILES | CCOC1=C(C(=O)C1=O)N2CCSCC2 |
Product Overview
3-Ethoxy-4-(4-thiomorpholinyl)-3-cyclobutene-1,2-dione (CAS 282093-50-9), with molecular formula C10H13NO3S and molecular weight 227.06 g/mol. IUPAC: 3-ethoxy-4-thiomorpholin-4-ylcyclobut-3-ene-1,2-dione.
Chemical Property Profile of 3-Ethoxy-4-(4-thiomorpholinyl)-3-cyclobutene-1,2-dione
Property Insights of 3-Ethoxy-4-(4-thiomorpholinyl)-3-cyclobutene-1,2-dione
The XLogP value of 0.2345 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Ethoxy-4-(4-thiomorpholinyl)-3-cyclobutene-1,2-dione. With a topological polar surface area (TPSA) of 46.61 Ų, 3-Ethoxy-4-(4-thiomorpholinyl)-3-cyclobutene-1,2-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Ethoxy-4-(4-thiomorpholinyl)-3-cyclobutene-1,2-dione has 0 hydrogen bond donor(s) and 5 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-Ethoxy-4-(4-thiomorpholinyl)-3-cyclobutene-1,2-dione?
The CAS number of 3-Ethoxy-4-(4-thiomorpholinyl)-3-cyclobutene-1,2-dione is 282093-50-9.
What is the molecular formula of 3-Ethoxy-4-(4-thiomorpholinyl)-3-cyclobutene-1,2-dione?
The molecular formula of 3-Ethoxy-4-(4-thiomorpholinyl)-3-cyclobutene-1,2-dione is C10H13NO3S.
What is the molecular weight of 3-Ethoxy-4-(4-thiomorpholinyl)-3-cyclobutene-1,2-dione?
The molecular weight of 3-Ethoxy-4-(4-thiomorpholinyl)-3-cyclobutene-1,2-dione is 227.06 g/mol.
Where can I buy 3-Ethoxy-4-(4-thiomorpholinyl)-3-cyclobutene-1,2-dione?
You can request a quote for 3-Ethoxy-4-(4-thiomorpholinyl)-3-cyclobutene-1,2-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Ethoxy-4-(4-thiomorpholinyl)-3-cyclobutene-1,2-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethoxy-4-(4-thiomorpholinyl)-3-cyclobutene-1,2-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.